N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide

C12H11N3O3 — CID 107697250

IUPACN-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide
SMILESNc1cc(O)ccc1NC(=O)c1ccncc1O
InChIInChI=1S/C12H11N3O3/c13-9-5-7(16)1-2-10(9)15-12(18)8-3-4-14-6-11(8)17/h1-6,16-17H,13H2,(H,15,18)
InChIKeyJNHFKWKFAWTBEP-UHFFFAOYSA-N
MW245.24 g/mol
LogP1.33
Rot. Bonds2

About N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide

N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide (PubChem CID 107697250) has the molecular formula C12H11N3O3 and a molecular weight of 245.24 g/mol. Its IUPAC name is N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide
PubChem CID107697250
Molecular FormulaC12H11N3O3
Molecular Weight245.24 g/mol
Exact Mass245.08
IUPAC NameN-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide
SMILESNc1cc(O)ccc1NC(=O)c1ccncc1O
InChIInChI=1S/C12H11N3O3/c13-9-5-7(16)1-2-10(9)15-12(18)8-3-4-14-6-11(8)17/h1-6,16-17H,13H2,(H,15,18)
InChIKeyJNHFKWKFAWTBEP-UHFFFAOYSA-N
XLogP1.33
TPSA108.47 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 51.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-[(3-hydroxypyridine-4-carbonyl)amino]benzoic acid
CID 81445608
N-(2-amino-4,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
CID 81446459
N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
CID 103144448
N-(3-amino-4-pyridinyl)-2-chloro-5-hydroxybenzamide
CID 106500113
2-[(3-hydroxypyridine-4-carbonyl)amino]-5-iodobenzoic acid
CID 81445870
5-fluoro-2-[(3-hydroxypyridine-4-carbonyl)amino]benzoic acid
CID 81446201
N-(2,4-dibromophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442512
2-fluoro-4-hydroxy-N-(3-hydroxy-4-pyridinyl)benzamide
CID 75447606
N-(2-amino-4-hydroxyphenyl)quinoline-4-carboxamide
CID 107697606
4,5-difluoro-2-[(3-hydroxypyridine-4-carbonyl)amino]benzoic acid
CID 81439837
2-amino-N-(3-bromo-4-pyridinyl)-5-hydroxybenzamide
CID 107075793
N-(2-acetylphenyl)-3-hydroxypyridine-4-carboxamide
CID 81446255

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide (CID 107697250) is N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide is Nc1cc(O)ccc1NC(=O)c1ccncc1O.
What is the InChIKey of N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide?
The InChIKey is JNHFKWKFAWTBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O3/c13-9-5-7(16)1-2-10(9)15-12(18)8-3-4-14-6-11(8)17/h1-6,16-17H,13H2,(H,15,18).
What are the key properties of N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide?
N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide has a molecular weight of 245.24 g/mol, XLogP of 1.33, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 107697250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).