6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid

C11H9N3O2 — CID 62746595

IUPAC6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(-c2cccnc2)n1
InChIInChI=1S/C11H9N3O2/c1-7-5-9(11(15)16)14-10(13-7)8-3-2-4-12-6-8/h2-6H,1H3,(H,15,16)
InChIKeyPQOXHJCDHJILKC-UHFFFAOYSA-N
MW215.21 g/mol
LogP1.55
Rot. Bonds2

About 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid

6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid (PubChem CID 62746595) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid
PubChem CID62746595
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC Name6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(-c2cccnc2)n1
InChIInChI=1S/C11H9N3O2/c1-7-5-9(11(15)16)14-10(13-7)8-3-2-4-12-6-8/h2-6H,1H3,(H,15,16)
InChIKeyPQOXHJCDHJILKC-UHFFFAOYSA-N
XLogP1.55
TPSA75.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-methyl-2-pyridin-3-ylpyrimidine-4-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

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid?
The IUPAC name of 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid (CID 62746595) is 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid.
What is the SMILES notation for 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid?
The canonical SMILES for 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid is Cc1cc(C(=O)O)nc(-c2cccnc2)n1.
What is the InChIKey of 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid?
The InChIKey is PQOXHJCDHJILKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c1-7-5-9(11(15)16)14-10(13-7)8-3-2-4-12-6-8/h2-6H,1H3,(H,15,16).
What are the key properties of 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid?
6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid has a molecular weight of 215.21 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-pyridin-3-ylpyrimidine-4-carboxylic acid is sourced from PubChem (CID 62746595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).