N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide

C13H13N3O2 — CID 81446196

IUPACN-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)c1ccccc1N
InChIInChI=1S/C13H13N3O2/c1-16(11-5-3-2-4-10(11)14)13(18)9-6-7-15-8-12(9)17/h2-8,17H,14H2,1H3
InChIKeyOBZZNYMOXNFQQN-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.65
Rot. Bonds2

About N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide

N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide (PubChem CID 81446196) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
PubChem CID81446196
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC NameN-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)c1ccccc1N
InChIInChI=1S/C13H13N3O2/c1-16(11-5-3-2-4-10(11)14)13(18)9-6-7-15-8-12(9)17/h2-8,17H,14H2,1H3
InChIKeyOBZZNYMOXNFQQN-UHFFFAOYSA-N
XLogP1.65
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.65
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

5-amino-2-[(3-hydroxypyridine-4-carbonyl)-methylamino]benzoic acid
CID 81439191
2-amino-N-(2-hydroxyphenyl)-N-methylbenzamide
CID 140987433
N-(3-amino-4-pyridinyl)-2-bromo-N-methylbenzamide
CID 61360177
N-(3-amino-4-pyridinyl)-3-chloro-N-methylpyridine-4-carboxamide
CID 66462789
N-(3-amino-4-pyridinyl)-3-methoxy-N-methylpyridine-4-carboxamide
CID 105063003
N-(3-amino-4-pyridinyl)-5-bromo-2-hydroxy-N-methylbenzamide
CID 107729224
N-(2-aminophenyl)-N,2,6-trimethylpyridine-3-carboxamide
CID 62831116
3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide
CID 80707419
2-[(2-aminobenzoyl)-methylamino]benzoic acid
CID 12819851
N-(3-amino-4-pyridinyl)-N-methylquinoline-5-carboxamide
CID 62848464
3-amino-4-[(3-fluoropyridine-4-carbonyl)-methylamino]benzoic acid
CID 64949272
N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide
CID 61358427

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The IUPAC name of N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide (CID 81446196) is N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccncc1O)c1ccccc1N.
What is the InChIKey of N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The InChIKey is OBZZNYMOXNFQQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-16(11-5-3-2-4-10(11)14)13(18)9-6-7-15-8-12(9)17/h2-8,17H,14H2,1H3.
What are the key properties of N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 81446196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).