N-methyl-1-(pyridin-2-yl)methanamine
Basic information
- CAS
21035-59-6- Standard SMILES
CNCc1ccccn1- InChIKey
OOTKJPZEEVPWCR-UHFFFAOYSA-N- Molecular formula
- C7H10N2
- Average molar mass
- 122.17 g/mol
- Monoisotopic mass
- 122.08439833
Overview
structure in first source; do not confuse with DMAP cpd
Names & identifiers
- Preferred name
- N-methyl-1-(pyridin-2-yl)methanamine
- IUPAC
- N-methyl-1-pyridin-2-ylmethanamine
- English name
- Methylpyridin-2-ylmethylamine dihydrochloride
- Molecular formula
- C7H10N2
- Molecular weight
- 122.17
Names & synonyms
N-Methyl-1-(pyridin-2-yl)methanamineDMAP amineRefChem:478261N-methyl-1-(pyridine-2-yl)methane amine21035-59-62-Pyridinemethanamine, N-methyl-2-[(METHYLAMINO)METHYL]PYRIDINEN-methyl-1-pyridin-2-ylmethanamineN-Methyl-N-(2-pyridylmethyl)amineMethyl(2-pyridylmethyl)amineMFCD020894072-Picolylmethylamine
Show more names
Einecs 244-160-1alpha-PicolylmethylamineN-Methyl-1-(pyridin-2-yl)N-Methyl-2-pyridinemethanamineN-Methylpyridine-2-methanamine
methyl[(pyridin-2-yl)methyl]amineN-methyl-2-picolylamineNCIOpen2_0002952-(methylaminomethyl)pyridine2-(N-methylaminomethyl)pyridinePyridine, 2-(methylaminomethyl)-BBL029574NSC 63910
Database identifiers
- CAS
21035-59-6- PubChem CID
- 88757
- DTXSID
DTXSID10175238- UNII
- EBR8435235
- EC Number
- 244-160-1
- Nikkaji
- J225.381J
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 73.3
Physicochemical properties
- Melting point
- 64 °C · 64 °C
- Boiling point
- 78 · 78-80 °C(Press: 10 Torr)
- Density
- 0.994 g/mL · 0.994 g/mL at 25 °C
- refractive index
- 20 · n20/D1.524
- Flash point
- 82 ℃ · 82℃
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- form
- liquid
- pka
- 1 · pK1:2.92(+2);pK2:8.82(+1) (30°C)
- color
- Colorless
- InChI
- 1S/C7H10N2/c1-8-6-7-4-2-3-5-9-7/h2-5,8H,6H2,1H3
- InChIKey
- OOTKJPZEEVPWCR-UHFFFAOYSA-N
- SMILES
- CNCc1ccccn1
- FDA UNII
- 8435235 · EBR8435235
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 261 · P261-P264-P280-P301+P312-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22-37/38-41
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- HS Code
- 2933399990 · 2933399990
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 2933399990
- risk_code
- 22-37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26
- hazard_class
- IRRITANT
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
- Hazard statements
- H302-H315-H318-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses2-[(Methylamino)methyl]pyridine is used as a reagent in the preparation and structure activity relationship of imidazolopyrimidones as gonadotropin-releasing hormone (GnRH) receptor antagonists.
Upstream & downstream products
Upstream raw materials
Related reactions
26 records
Compound notes
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