4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid

C11H9N3O3S — CID 175184859

IUPAC4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid
SMILESCc1cccc(C(=O)Nc2ncsc2C(=O)O)n1
InChIInChI=1S/C11H9N3O3S/c1-6-3-2-4-7(13-6)10(15)14-9-8(11(16)17)18-5-12-9/h2-5H,1H3,(H,14,15)(H,16,17)
InChIKeyWSNLDBFYIHYFTC-UHFFFAOYSA-N
MW263.28 g/mol
LogP1.80
Rot. Bonds3

About 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid

4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid (PubChem CID 175184859) has the molecular formula C11H9N3O3S and a molecular weight of 263.28 g/mol. Its IUPAC name is 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid.

Molecular Properties

Compound Name4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid
PubChem CID175184859
Molecular FormulaC11H9N3O3S
Molecular Weight263.28 g/mol
Exact Mass263.04
IUPAC Name4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid
SMILESCc1cccc(C(=O)Nc2ncsc2C(=O)O)n1
InChIInChI=1S/C11H9N3O3S/c1-6-3-2-4-7(13-6)10(15)14-9-8(11(16)17)18-5-12-9/h2-5H,1H3,(H,14,15)(H,16,17)
InChIKeyWSNLDBFYIHYFTC-UHFFFAOYSA-N
XLogP1.80
TPSA92.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.28
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide
CID 47152291
6-methyl-N-(3-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46642959
N-(2-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31700169
2-[(6-methylpyridine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
CID 43145448
2-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-4-carboxamide
CID 110472181
N-(4-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31777667
N-(4-aminophenyl)-6-methylpyridine-2-carboxamide
CID 16784436
N-(3-chlorophenyl)-6-methylpyridine-2-carboxamide
CID 31698646
N-(5-chloropyrazin-2-yl)-6-methylpyridine-2-carboxamide
CID 104964202
2-[(6-methylpyridine-2-carbonyl)amino]-3-sulfanylpropanoic acid
CID 16794367
N-(3-chloro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 31759188
N-(6-bromo-3-pyridinyl)-6-methylpyridine-2-carboxamide
CID 103789394

Frequently Asked Questions

What is the IUPAC name of 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid?
The IUPAC name of 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid (CID 175184859) is 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid.
What is the SMILES notation for 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid?
The canonical SMILES for 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid is Cc1cccc(C(=O)Nc2ncsc2C(=O)O)n1.
What is the InChIKey of 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid?
The InChIKey is WSNLDBFYIHYFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O3S/c1-6-3-2-4-7(13-6)10(15)14-9-8(11(16)17)18-5-12-9/h2-5H,1H3,(H,14,15)(H,16,17).
What are the key properties of 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid?
4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid has a molecular weight of 263.28 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-5-carboxylic acid is sourced from PubChem (CID 175184859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).