2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide

C14H15N3O2 — CID 28527658

IUPAC2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(CNc2ncccc2C(N)=O)cc1
InChIInChI=1S/C14H15N3O2/c1-19-11-6-4-10(5-7-11)9-17-14-12(13(15)18)3-2-8-16-14/h2-8H,9H2,1H3,(H2,15,18)(H,16,17)
InChIKeyNMPWHVJEOGHDDX-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.80
Rot. Bonds5

About 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide

2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide (PubChem CID 28527658) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
PubChem CID28527658
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(CNc2ncccc2C(N)=O)cc1
InChIInChI=1S/C14H15N3O2/c1-19-11-6-4-10(5-7-11)9-17-14-12(13(15)18)3-2-8-16-14/h2-8H,9H2,1H3,(H2,15,18)(H,16,17)
InChIKeyNMPWHVJEOGHDDX-UHFFFAOYSA-N
XLogP1.80
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-3-pyridinyl)-2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 3320057
3-fluoro-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
CID 62735098
3-[(4-methoxyphenyl)methylamino]pyrazine-2-carboxylic acid
CID 62710099
2-[(4-chlorophenyl)methylamino]-N-[[1-[(4-methoxyphenyl)methyl]triazol-4-yl]methyl]pyridine-3-carboxamide
CID 118148766
2-[(4-ethylphenyl)methylamino]pyridine-3-carboxylic acid
CID 106900004
5-bromo-3-[(4-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 89346524
2-[(4-methoxyphenyl)methylcarbamoyl]pyridine-3-carboxylic acid
CID 19154817
2-(cyclopropylamino)-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 84573928
2-[[2-(dimethylamino)-2-oxoethyl]amino]pyridine-3-carboxamide
CID 43311020
2-[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]pyridine-3-carboxamide
CID 114180640
methyl 2-[(2-methoxy-4-pyridinyl)methylamino]pyridine-3-carboxylate
CID 60724684
1-[(4-methoxyphenyl)methyl]-3-(3-methyl-2-pyridinyl)urea
CID 47235934

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide (CID 28527658) is 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide is COc1ccc(CNc2ncccc2C(N)=O)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is NMPWHVJEOGHDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-19-11-6-4-10(5-7-11)9-17-14-12(13(15)18)3-2-8-16-14/h2-8H,9H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide?
2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 28527658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).