Piperazine, 1-(3-amino-4-pyridyl)-4-methyl-
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Basic information
- CAS
14549-59-8- Standard SMILES
CN1CCN(c2ccncc2N)CC1- InChIKey
UAJACUSQLFALEQ-UHFFFAOYSA-N- Molecular formula
- C10H16N4
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.13749651
Names & identifiers
- Preferred name
- Piperazine, 1-(3-amino-4-pyridyl)-4-methyl-
- IUPAC
- 4-(4-methylpiperazin-1-yl)pyridin-3-amine
- English name
- 4-(4-Methyl-1-piperazinyl)-3-pyridinamine
- Molecular formula
- C10H16N4
- Molecular weight
- 192.26
Names & synonyms
4-(4-methylpiperazin-1-yl)pyridin-3-amine14549-59-8Piperazine, 1-(3-amino-4-pyridyl)-4-methyl-BRN 06133661-(3-Amino-4-pyridyl)-4-methylpiperazine4-Methyl-1-(3-amino-4-pyridyl)piperazineDTXSID40163062RefChem:863421DTXCID8085553966-075-54-(4-Methyl-1-piperazinyl)-3-pyridinamine3-Pyridinamine, 4-(4-methyl-1-piperazinyl)-
Show more names
4-(4-Methyl-piperazin-1-yl)-pyridin-3-ylamine4-(4-methyl-piperazin-1-yl)-pyridin-3-amine4-(4-methylpiperazin-1-yl)pyridin-3-amine
MFCD01704019CHEMBL4585317SCHEMBL15770645UAJACUSQLFALEQ-UHFFFAOYSA-NB63B82T8Z5PAA54959AKOS008116024KS-8822
Database identifiers
- CAS
14549-59-8- PubChem CID
- 203473
- DTXSID
DTXSID40163062- ChEMBL
CHEMBL4585317- UNII
- B63B82T8Z5
- EC Number
- 966-075-5
- Nikkaji
- J50.547A
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Boiling point
- 361.6 · 361.6±42.0 °C(Predicted)
- Density
- 1.142 · 1.142±0.06 g/cm3(Predicted)
- pka
- 11.74 · 11.74±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
2 records
Compound notes
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