4-pyrimidin-5-ylpyridine-2-carboxylic acid

C10H7N3O2 — CID 130927347

IUPAC4-pyrimidin-5-ylpyridine-2-carboxylic acid
SMILESO=C(O)c1cc(-c2cncnc2)ccn1
InChIInChI=1S/C10H7N3O2/c14-10(15)9-3-7(1-2-13-9)8-4-11-6-12-5-8/h1-6H,(H,14,15)
InChIKeyAIIRBCIEDPYUJY-UHFFFAOYSA-N
MW201.19 g/mol
LogP1.24
Rot. Bonds2

About 4-pyrimidin-5-ylpyridine-2-carboxylic acid

4-pyrimidin-5-ylpyridine-2-carboxylic acid (PubChem CID 130927347) has the molecular formula C10H7N3O2 and a molecular weight of 201.19 g/mol. Its IUPAC name is 4-pyrimidin-5-ylpyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-pyrimidin-5-ylpyridine-2-carboxylic acid
PubChem CID130927347
Molecular FormulaC10H7N3O2
Molecular Weight201.19 g/mol
Exact Mass201.05
IUPAC Name4-pyrimidin-5-ylpyridine-2-carboxylic acid
SMILESO=C(O)c1cc(-c2cncnc2)ccn1
InChIInChI=1S/C10H7N3O2/c14-10(15)9-3-7(1-2-13-9)8-4-11-6-12-5-8/h1-6H,(H,14,15)
InChIKeyAIIRBCIEDPYUJY-UHFFFAOYSA-N
XLogP1.24
TPSA75.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-pyrimidin-5-ylpyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(1H-pyrazol-4-yl)pyridine-2-carboxylic acid
CID 82404796
4-(3,4-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53223762
4-(3,5-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53223777
4-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyridine-2-carboxylic acid
CID 82388447
4-(3-acetylphenyl)pyridine-2-carboxylic acid
CID 53223096
4-(1,3-benzodioxol-5-yl)pyridine-2-carboxylic acid
CID 53223206
4-[3-(difluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 171433762
4-(3-methylsulfonylphenyl)pyridine-2-carboxylic acid
CID 53224214
4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid
CID 58138528
hydrazine;pyridine-2,4-dicarboxylic acid
CID 71369189
4-aminopyridine-2-carboxylic acid;hydrate
CID 74892475
4-chloropyridine-2-carboxylic acid;dihydrochloride
CID 174449778

Frequently Asked Questions

What is the IUPAC name of 4-pyrimidin-5-ylpyridine-2-carboxylic acid?
The IUPAC name of 4-pyrimidin-5-ylpyridine-2-carboxylic acid (CID 130927347) is 4-pyrimidin-5-ylpyridine-2-carboxylic acid.
What is the SMILES notation for 4-pyrimidin-5-ylpyridine-2-carboxylic acid?
The canonical SMILES for 4-pyrimidin-5-ylpyridine-2-carboxylic acid is O=C(O)c1cc(-c2cncnc2)ccn1.
What is the InChIKey of 4-pyrimidin-5-ylpyridine-2-carboxylic acid?
The InChIKey is AIIRBCIEDPYUJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O2/c14-10(15)9-3-7(1-2-13-9)8-4-11-6-12-5-8/h1-6H,(H,14,15).
What are the key properties of 4-pyrimidin-5-ylpyridine-2-carboxylic acid?
4-pyrimidin-5-ylpyridine-2-carboxylic acid has a molecular weight of 201.19 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrimidin-5-ylpyridine-2-carboxylic acid is sourced from PubChem (CID 130927347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).