2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid

C12H10N2O3 — CID 135567039

IUPAC2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid
SMILESNc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1
InChIInChI=1S/C12H10N2O3/c13-8-1-2-11(15)9(6-8)10-5-7(12(16)17)3-4-14-10/h1-6,15H,13H2,(H,16,17)
InChIKeyBJCZMMOGTXVENP-UHFFFAOYSA-N
MW230.22 g/mol
LogP1.73
Rot. Bonds2

About 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid

2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid (PubChem CID 135567039) has the molecular formula C12H10N2O3 and a molecular weight of 230.22 g/mol. Its IUPAC name is 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid
PubChem CID135567039
Molecular FormulaC12H10N2O3
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid
SMILESNc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1
InChIInChI=1S/C12H10N2O3/c13-8-1-2-11(15)9(6-8)10-5-7(12(16)17)3-4-14-10/h1-6,15H,13H2,(H,16,17)
InChIKeyBJCZMMOGTXVENP-UHFFFAOYSA-N
XLogP1.73
TPSA96.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Phenopicolinic acid
CID 3043792
2-Methyl-3-[(pyridin-3-ylmethyl)-amino]-benzoic acid
CID 6492091
2-Hydroxy-5-(1H-pyrrol-1-yl)benzoic acid
CID 853752
(E)-1-(2-hydroxyphenyl)-3-pyridin-3-ylprop-2-en-1-one
CID 5356048
3-[(Pyridin-3-ylmethyl)-amino]-benzoic acid
CID 935607
4-(2-Pyridyl)Benzoic Acid
CID 821692
2-hydroxy-N-((pyridin-2-yl)methyl)benzamide
CID 778091
2-[5-(2-Methoxyethanoylamino)-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567037
2-[5-[(5-Methyl-1,2-oxazol-3-yl)carbonylamino]-2-oxidanyl-phenyl]pyridine-4-carboxylic acid
CID 135567038
2-[5-[(4-Hydroxyphenyl)carbonylamino]-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567041
2-[5-[2-(3-Methoxyphenyl)ethanoylamino]-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567042
CA standard inhibitor, 2
CID 19564789

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The IUPAC name of 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid (CID 135567039) is 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid is Nc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1.
What is the InChIKey of 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The InChIKey is BJCZMMOGTXVENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3/c13-8-1-2-11(15)9(6-8)10-5-7(12(16)17)3-4-14-10/h1-6,15H,13H2,(H,16,17).
What are the key properties of 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid?
2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid has a molecular weight of 230.22 g/mol, XLogP of 1.73, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-hydroxyphenyl)pyridine-4-carboxylic acid is sourced from PubChem (CID 135567039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).