N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide

C13H13N3O2 — CID 16776915

IUPACN-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccncc2)c(N)c1
InChIInChI=1S/C13H13N3O2/c1-18-10-2-3-12(11(14)8-10)16-13(17)9-4-6-15-7-5-9/h2-8H,14H2,1H3,(H,16,17)
InChIKeyFXBNEYUVCACTIW-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.92
Rot. Bonds3

About N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide

N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 16776915) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide
PubChem CID16776915
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC NameN-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccncc2)c(N)c1
InChIInChI=1S/C13H13N3O2/c1-18-10-2-3-12(11(14)8-10)16-13(17)9-4-6-15-7-5-9/h2-8H,14H2,1H3,(H,16,17)
InChIKeyFXBNEYUVCACTIW-UHFFFAOYSA-N
XLogP1.92
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4-methoxyphenyl)pyrimidine-5-carboxamide
CID 102921224
N-(2-amino-4-methoxyphenyl)-3,4-dichlorobenzamide
CID 16777237
3-amino-4-[(4-methoxybenzoyl)amino]benzoic acid
CID 63117294
ethyl (E)-3-(2-amino-4-methoxyanilino)-3-pyridin-4-ylprop-2-enoate
CID 66486874
N-(2-amino-4-methoxyphenyl)naphthalene-2-carboxamide
CID 16775616
N-(2-amino-4-fluorophenyl)pyridine-4-carboxamide
CID 16772506
(2-amino-4-methoxyphenyl)carbamic acid
CID 22317519
N-(2-amino-4-methoxyphenyl)-3-bromo-4-chlorobenzamide
CID 107997479
N-(2-amino-4-methoxyphenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 65199378
4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
N-(2-amino-4-ethoxyphenyl)-4-ethoxybenzamide
CID 91687646
N-(4-bromo-2-methoxyphenyl)pyridine-4-carboxamide
CID 2174953

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide (CID 16776915) is N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide is COc1ccc(NC(=O)c2ccncc2)c(N)c1.
What is the InChIKey of N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is FXBNEYUVCACTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-18-10-2-3-12(11(14)8-10)16-13(17)9-4-6-15-7-5-9/h2-8H,14H2,1H3,(H,16,17).
What are the key properties of N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide?
N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 16776915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).