6-cyclopropyl-5-methylpyridine-2-carboxylic acid

C10H11NO2 — CID 118990646

IUPAC6-cyclopropyl-5-methylpyridine-2-carboxylic acid
SMILESCc1ccc(C(=O)O)nc1C1CC1
InChIInChI=1S/C10H11NO2/c1-6-2-5-8(10(12)13)11-9(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H,12,13)
InChIKeyJLCXLLRMJOJILJ-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.97
Rot. Bonds2

About 6-cyclopropyl-5-methylpyridine-2-carboxylic acid

6-cyclopropyl-5-methylpyridine-2-carboxylic acid (PubChem CID 118990646) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 6-cyclopropyl-5-methylpyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-cyclopropyl-5-methylpyridine-2-carboxylic acid
PubChem CID118990646
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name6-cyclopropyl-5-methylpyridine-2-carboxylic acid
SMILESCc1ccc(C(=O)O)nc1C1CC1
InChIInChI=1S/C10H11NO2/c1-6-2-5-8(10(12)13)11-9(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H,12,13)
InChIKeyJLCXLLRMJOJILJ-UHFFFAOYSA-N
XLogP1.97
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-cyclopropyl-5-methylpyridine-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

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-5-methylpyridine-2-carboxylic acid?
The IUPAC name of 6-cyclopropyl-5-methylpyridine-2-carboxylic acid (CID 118990646) is 6-cyclopropyl-5-methylpyridine-2-carboxylic acid.
What is the SMILES notation for 6-cyclopropyl-5-methylpyridine-2-carboxylic acid?
The canonical SMILES for 6-cyclopropyl-5-methylpyridine-2-carboxylic acid is Cc1ccc(C(=O)O)nc1C1CC1.
What is the InChIKey of 6-cyclopropyl-5-methylpyridine-2-carboxylic acid?
The InChIKey is JLCXLLRMJOJILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-6-2-5-8(10(12)13)11-9(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H,12,13).
What are the key properties of 6-cyclopropyl-5-methylpyridine-2-carboxylic acid?
6-cyclopropyl-5-methylpyridine-2-carboxylic acid has a molecular weight of 177.20 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-5-methylpyridine-2-carboxylic acid is sourced from PubChem (CID 118990646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).