2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide

C15H14N4O2 — CID 107467795

IUPAC2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1cccc(C#N)c1NC(=O)c1ccnc(CN)c1
InChIInChI=1S/C15H14N4O2/c1-21-13-4-2-3-11(8-16)14(13)19-15(20)10-5-6-18-12(7-10)9-17/h2-7H,9,17H2,1H3,(H,19,20)
InChIKeyQSXGFKWCHLGRQV-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.67
Rot. Bonds4

About 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide

2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 107467795) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide
PubChem CID107467795
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1cccc(C#N)c1NC(=O)c1ccnc(CN)c1
InChIInChI=1S/C15H14N4O2/c1-21-13-4-2-3-11(8-16)14(13)19-15(20)10-5-6-18-12(7-10)9-17/h2-7H,9,17H2,1H3,(H,19,20)
InChIKeyQSXGFKWCHLGRQV-UHFFFAOYSA-N
XLogP1.67
TPSA101.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107468118
N-(2-cyano-6-methoxyphenyl)-1H-pyrazole-4-carboxamide
CID 107468068
5-amino-N-(2-cyano-6-methoxyphenyl)pyridine-2-carboxamide
CID 107466429
4-(chloromethyl)-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107467181
2-(aminomethyl)-N-(3-hydroxy-4-methoxyphenyl)pyridine-4-carboxamide
CID 114325849
2-(aminomethyl)-N-(3-bromo-4-methoxyphenyl)pyridine-4-carboxamide
CID 114326705
6-amino-N-(2-cyano-6-methoxyphenyl)pyridazine-3-carboxamide
CID 107469830
2,4-diamino-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107466376
3-chloro-N-(2-cyano-6-methoxyphenyl)-5-methylbenzamide
CID 107468127
N-(2-cyano-6-methoxyphenyl)-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 107468124
3-amino-N-(2-cyano-6-methoxyphenyl)-2-methoxypropanamide
CID 106114168
N-(2-cyano-6-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 107468982

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide (CID 107467795) is 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide is COc1cccc(C#N)c1NC(=O)c1ccnc(CN)c1.
What is the InChIKey of 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is QSXGFKWCHLGRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-13-4-2-3-11(8-16)14(13)19-15(20)10-5-6-18-12(7-10)9-17/h2-7H,9,17H2,1H3,(H,19,20).
What are the key properties of 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide?
2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-cyano-6-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 107467795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).