Basic information
- CAS
552814-16-1- Standard SMILES
COc1cc(N)ccc1NC(=O)c1cccnc1- InChIKey
FYMHBXHJILVCKD-UHFFFAOYSA-N- Molecular formula
- C13H13N3O2
- Average molar mass
- 243.26 g/mol
- Monoisotopic mass
- 243.10077667
Names & identifiers
- Preferred name
- N-(4-Amino-2-methoxyphenyl)-3-pyridinecarboxamide
- IUPAC
- N-(4-amino-2-methoxyphenyl)pyridine-3-carboxamide
- English name
- N-(4-amino-2-methoxyphenyl)nicotinamide
- Molecular formula
- C13H13N3O2
- Molecular weight
- 243.26
Names & synonyms
552814-16-1N-(4-amino-2-methoxyphenyl)pyridine-3-carboxamideDTXSID401232682N-(4-Amino-2-methoxyphenyl)-3-pyridinecarboxamideRefChem:827094DTXCID001663887103-717-8N-(4-amino-2-methoxyphenyl)nicotinamideOprea1_858088SCHEMBL16592594SCHEMBL29886212AKOS000127059
Show more names
3-Pyridinecarboxamide, N-(4-amino-2-methoxyphenyl)-
EN300-36913G42977Z239121654
Database identifiers
- CAS
552814-16-1- PubChem CID
- 856136
- DTXSID
DTXSID401232682- EC Number
- 103-717-8
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…