5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid

C10H7N3O4 — CID 135446970

IUPAC5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid
SMILESO=C(O)c1nc(-c2ccccn2)[nH]c(=O)c1O
InChIInChI=1S/C10H7N3O4/c14-7-6(10(16)17)12-8(13-9(7)15)5-3-1-2-4-11-5/h1-4,14H,(H,16,17)(H,12,13,15)
InChIKeyGHGUXTXCARENBN-UHFFFAOYSA-N
MW233.18 g/mol
LogP0.24
Rot. Bonds2

About 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid

5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid (PubChem CID 135446970) has the molecular formula C10H7N3O4 and a molecular weight of 233.18 g/mol. Its IUPAC name is 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid
PubChem CID135446970
Molecular FormulaC10H7N3O4
Molecular Weight233.18 g/mol
Exact Mass233.04
IUPAC Name5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid
SMILESO=C(O)c1nc(-c2ccccn2)[nH]c(=O)c1O
InChIInChI=1S/C10H7N3O4/c14-7-6(10(16)17)12-8(13-9(7)15)5-3-1-2-4-11-5/h1-4,14H,(H,16,17)(H,12,13,15)
InChIKeyGHGUXTXCARENBN-UHFFFAOYSA-N
XLogP0.24
TPSA116.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.18
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-Methyl-2-(pyridin-2-yl)pyrimidin-4-ol
CID 135472985
5-Methoxy-2-(pyridin-2-yl)pyrimidin-4-ol
CID 2763499
6-Amino-2-(pyridin-2-yl)pyrimidin-4(3H)-one
CID 135482584
3-hydroxy-1H-1,5-naphthyridin-2-one
CID 135894470
4-Oxo-4-[(2-pyridinylmethyl)amino]-2-butenoic acid
CID 818477
N-(cyclohexylmethyl)-5,6-dihydroxy-2-(2-pyridyl)pyrimidine-4-carboxamide
CID 136593211
N-(2-cyclohexylethyl)-5,6-dihydroxy-2-(2-pyridyl)pyrimidine-4-carboxamide
CID 137297043
5,6-Dihydroxy-2-pyridin-2-YL-pyrimidine-4-carboxylic acid methyl ester
CID 135446253
N-benzyl-5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxamide
CID 135602094
N-cyclohexyl-5,6-dihydroxy-2-(2-pyridyl)pyrimidine-4-carboxamide
CID 136593190
5-Hydroxy-1-methyl-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxylic acid
CID 135788271
5-Hydroxy-6-oxo-3,7,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,10,12-pentaene-4-carboxylic acid
CID 136254253

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid?
The IUPAC name of 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid (CID 135446970) is 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid.
What is the SMILES notation for 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid?
The canonical SMILES for 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid is O=C(O)c1nc(-c2ccccn2)[nH]c(=O)c1O.
What is the InChIKey of 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid?
The InChIKey is GHGUXTXCARENBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O4/c14-7-6(10(16)17)12-8(13-9(7)15)5-3-1-2-4-11-5/h1-4,14H,(H,16,17)(H,12,13,15).
What are the key properties of 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid?
5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid has a molecular weight of 233.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxylic acid is sourced from PubChem (CID 135446970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).