6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid

C10H7N3O4 — CID 62915437

IUPAC6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(C(=O)Nc2cnoc2)n1
InChIInChI=1S/C10H7N3O4/c14-9(12-6-4-11-17-5-6)7-2-1-3-8(13-7)10(15)16/h1-5H,(H,12,14)(H,15,16)
InChIKeyAHJBDGGFCFDROJ-UHFFFAOYSA-N
MW233.18 g/mol
LogP1.02
Rot. Bonds3

About 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid

6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid (PubChem CID 62915437) has the molecular formula C10H7N3O4 and a molecular weight of 233.18 g/mol. Its IUPAC name is 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid
PubChem CID62915437
Molecular FormulaC10H7N3O4
Molecular Weight233.18 g/mol
Exact Mass233.04
IUPAC Name6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(C(=O)Nc2cnoc2)n1
InChIInChI=1S/C10H7N3O4/c14-9(12-6-4-11-17-5-6)7-2-1-3-8(13-7)10(15)16/h1-5H,(H,12,14)(H,15,16)
InChIKeyAHJBDGGFCFDROJ-UHFFFAOYSA-N
XLogP1.02
TPSA105.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.18
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-(1,2-oxazol-4-yl)pyridine-2-carboxamide
CID 62914715
6-bromo-N-(1,2-oxazol-4-yl)pyridine-2-carboxamide
CID 103889880
6-hydrazinyl-N-(1,2-oxazol-4-yl)pyridine-2-carboxamide
CID 62913247
6-[[3-(methylaminomethyl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 61408010
N-(1,2-oxazol-4-yl)pyridine-4-carboxamide
CID 71797676
6-[(2,6-dimethylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558422
6-[(2,6-dibromophenyl)carbamoyl]pyridine-2-carboxylic acid
CID 107602474
CID 91986542
CID 91986542
5-amino-N-(1,2-oxazol-4-yl)-1,2-oxazole-3-carboxamide
CID 130563046
3-amino-2-methyl-N-(1,2-oxazol-4-yl)benzamide
CID 62902054
6-[(2-chloro-6-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 66254491
6-chloro-N-(1,2-oxazol-4-yl)pyridine-3-carboxamide
CID 62415435

Frequently Asked Questions

What is the IUPAC name of 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid (CID 62915437) is 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid is O=C(O)c1cccc(C(=O)Nc2cnoc2)n1.
What is the InChIKey of 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid?
The InChIKey is AHJBDGGFCFDROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O4/c14-9(12-6-4-11-17-5-6)7-2-1-3-8(13-7)10(15)16/h1-5H,(H,12,14)(H,15,16).
What are the key properties of 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid?
6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid has a molecular weight of 233.18 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,2-oxazol-4-ylcarbamoyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 62915437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).