4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid

C12H10N2O2 — CID 140683950

IUPAC4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid
SMILESCc1c(C(=O)O)cncc1-c1ccncc1
InChIInChI=1S/C12H10N2O2/c1-8-10(9-2-4-13-5-3-9)6-14-7-11(8)12(15)16/h2-7H,1H3,(H,15,16)
InChIKeyGHFPSTPNZCHPLT-UHFFFAOYSA-N
MW214.22 g/mol
LogP2.15
Rot. Bonds2

About 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid

4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid (PubChem CID 140683950) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid
PubChem CID140683950
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid
SMILESCc1c(C(=O)O)cncc1-c1ccncc1
InChIInChI=1S/C12H10N2O2/c1-8-10(9-2-4-13-5-3-9)6-14-7-11(8)12(15)16/h2-7H,1H3,(H,15,16)
InChIKeyGHFPSTPNZCHPLT-UHFFFAOYSA-N
XLogP2.15
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-5-pyridin-4-ylpyridine-3-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

3-(4-methylphenyl)pyridine-4-carboxylic acid
CID 19865918
2,5-dipyridin-4-ylterephthalic acid
CID 163197795
5-hydroxy-4-methylpyridine-3-carboxylic acid
CID 105429833
5-[4-[(1S)-1-(methanesulfonamido)ethyl]phenyl]-4-methylpyridine-3-carboxylic acid
CID 167798818
2,4-dimethyl-5-pyridin-4-ylbenzoic acid
CID 107515528
bis(benzene-1,2,4,5-tetracarboxylic acid);4-pyridin-4-ylpyridine
CID 71380958
4-pyridin-4-ylthiophene-3-carboxylic acid
CID 83235084
5-(4-methyl-3-pyridinyl)-1,2-oxazole-4-carboxylic acid
CID 131572455
3-(4-carboxy-3-pyridinyl)pyridine-4-carboxylic acid
CID 91435588
4-methyl-5-(5-propoxy-3-pyridinyl)pyridine-3-carboxylic acid
CID 167815932
3-(4-methylsulfonylphenyl)pyridine-4-carboxylic acid
CID 53224225
5-pyridin-4-ylnaphthalene-1-carboxylic acid
CID 22118910

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid?
The IUPAC name of 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid (CID 140683950) is 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid.
What is the SMILES notation for 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid?
The canonical SMILES for 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid is Cc1c(C(=O)O)cncc1-c1ccncc1.
What is the InChIKey of 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid?
The InChIKey is GHFPSTPNZCHPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c1-8-10(9-2-4-13-5-3-9)6-14-7-11(8)12(15)16/h2-7H,1H3,(H,15,16).
What are the key properties of 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid?
4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid has a molecular weight of 214.22 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid is sourced from PubChem (CID 140683950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).