3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid

C12H10N2O3S — CID 16782205

IUPAC3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid
SMILESCc1ccc(C(=O)Nc2ccsc2C(=O)O)cn1
InChIInChI=1S/C12H10N2O3S/c1-7-2-3-8(6-13-7)11(15)14-9-4-5-18-10(9)12(16)17/h2-6H,1H3,(H,14,15)(H,16,17)
InChIKeyXFFKAXQVYDALOZ-UHFFFAOYSA-N
MW262.29 g/mol
LogP2.40
Rot. Bonds3

About 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid

3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid (PubChem CID 16782205) has the molecular formula C12H10N2O3S and a molecular weight of 262.29 g/mol. Its IUPAC name is 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid
PubChem CID16782205
Molecular FormulaC12H10N2O3S
Molecular Weight262.29 g/mol
Exact Mass262.04
IUPAC Name3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid
SMILESCc1ccc(C(=O)Nc2ccsc2C(=O)O)cn1
InChIInChI=1S/C12H10N2O3S/c1-7-2-3-8(6-13-7)11(15)14-9-4-5-18-10(9)12(16)17/h2-6H,1H3,(H,14,15)(H,16,17)
InChIKeyXFFKAXQVYDALOZ-UHFFFAOYSA-N
XLogP2.40
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-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

3-(pyridine-3-carbonylamino)thiophene-2-carboxylic acid
CID 16773059
3-[(4-methylsulfanylbenzoyl)amino]thiophene-2-carboxylic acid
CID 43358110
5-methyl-2-[(6-methylpyridine-3-carbonyl)amino]benzoic acid
CID 24702059
3-[(3,4-diethoxybenzoyl)amino]thiophene-2-carboxylic acid
CID 16776584
5-bromo-2-[(6-methylpyridine-3-carbonyl)amino]benzoic acid
CID 62050351
5-fluoro-2-[(6-methylpyridine-3-carbonyl)amino]benzoic acid
CID 24690411
2-(4-bromophenyl)-4-[(6-methylpyridine-3-carbonyl)amino]thiophene-3-carboxylic acid
CID 58191184
3-[(3,4,5-trimethoxybenzoyl)amino]thiophene-2-carboxylic acid
CID 16774257
N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-3-carboxamide
CID 51331568
3-[(4-methylbenzoyl)amino]thiophene-2-carboxylate
CID 6987136
3-[(6-methylpyridine-3-carbonyl)amino]benzoic acid
CID 16793648
N-(4-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 18148116

Frequently Asked Questions

What is the IUPAC name of 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid?
The IUPAC name of 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid (CID 16782205) is 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid.
What is the SMILES notation for 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid?
The canonical SMILES for 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid is Cc1ccc(C(=O)Nc2ccsc2C(=O)O)cn1.
What is the InChIKey of 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid?
The InChIKey is XFFKAXQVYDALOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3S/c1-7-2-3-8(6-13-7)11(15)14-9-4-5-18-10(9)12(16)17/h2-6H,1H3,(H,14,15)(H,16,17).
What are the key properties of 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid?
3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid has a molecular weight of 262.29 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methylpyridine-3-carbonyl)amino]thiophene-2-carboxylic acid is sourced from PubChem (CID 16782205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).