4-amino-3-methylpyridine-2-carboxylic acid

C7H8N2O2 — CID 58233040

IUPAC4-amino-3-methylpyridine-2-carboxylic acid
SMILESCc1c(N)ccnc1C(=O)O
InChIInChI=1S/C7H8N2O2/c1-4-5(8)2-3-9-6(4)7(10)11/h2-3H,1H3,(H2,8,9)(H,10,11)
InChIKeyVMMWLTQRNQCQSC-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.67
Rot. Bonds1

About 4-amino-3-methylpyridine-2-carboxylic acid

4-amino-3-methylpyridine-2-carboxylic acid (PubChem CID 58233040) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 4-amino-3-methylpyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-3-methylpyridine-2-carboxylic acid
PubChem CID58233040
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name4-amino-3-methylpyridine-2-carboxylic acid
SMILESCc1c(N)ccnc1C(=O)O
InChIInChI=1S/C7H8N2O2/c1-4-5(8)2-3-9-6(4)7(10)11/h2-3H,1H3,(H2,8,9)(H,10,11)
InChIKeyVMMWLTQRNQCQSC-UHFFFAOYSA-N
XLogP0.67
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-3-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 4-amino-3-methylpyridine-2-carboxylic acid?
The IUPAC name of 4-amino-3-methylpyridine-2-carboxylic acid (CID 58233040) is 4-amino-3-methylpyridine-2-carboxylic acid.
What is the SMILES notation for 4-amino-3-methylpyridine-2-carboxylic acid?
The canonical SMILES for 4-amino-3-methylpyridine-2-carboxylic acid is Cc1c(N)ccnc1C(=O)O.
What is the InChIKey of 4-amino-3-methylpyridine-2-carboxylic acid?
The InChIKey is VMMWLTQRNQCQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-4-5(8)2-3-9-6(4)7(10)11/h2-3H,1H3,(H2,8,9)(H,10,11).
What are the key properties of 4-amino-3-methylpyridine-2-carboxylic acid?
4-amino-3-methylpyridine-2-carboxylic acid has a molecular weight of 152.15 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methylpyridine-2-carboxylic acid is sourced from PubChem (CID 58233040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).