5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid

C10H8N4O3S — CID 113246377

IUPAC5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid
SMILESCc1nsc(NC(=O)c2ccc(C(=O)O)nc2)n1
InChIInChI=1S/C10H8N4O3S/c1-5-12-10(18-14-5)13-8(15)6-2-3-7(9(16)17)11-4-6/h2-4H,1H3,(H,16,17)(H,12,13,14,15)
InChIKeyCCDPKCRNVKVAIB-UHFFFAOYSA-N
MW264.27 g/mol
LogP1.19
Rot. Bonds3

About 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid

5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid (PubChem CID 113246377) has the molecular formula C10H8N4O3S and a molecular weight of 264.27 g/mol. Its IUPAC name is 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid
PubChem CID113246377
Molecular FormulaC10H8N4O3S
Molecular Weight264.27 g/mol
Exact Mass264.03
IUPAC Name5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid
SMILESCc1nsc(NC(=O)c2ccc(C(=O)O)nc2)n1
InChIInChI=1S/C10H8N4O3S/c1-5-12-10(18-14-5)13-8(15)6-2-3-7(9(16)17)11-4-6/h2-4H,1H3,(H,16,17)(H,12,13,14,15)
InChIKeyCCDPKCRNVKVAIB-UHFFFAOYSA-N
XLogP1.19
TPSA105.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-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

5-[(4-tert-butyl-1,3-thiazol-2-yl)carbamoyl]pyridine-2-carboxylic acid
CID 60725123
N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 115661254
4-(aminomethyl)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
CID 104694500
2-fluoro-N-(3-methyl-1,2,4-thiadiazol-5-yl)pyridine-4-carboxamide
CID 115661242
3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
CID 91900874
4-fluoro-2-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
CID 115745910
5-[(4-methyl-1,3-thiazol-5-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 55171882
5-[(5-chloro-2-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43414752
5-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 60725191
5-[(4-bromophenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43414649
3-hydroxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-4-nitrobenzamide
CID 103712002
5-[(3-bromo-2-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 103644305

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid?
The IUPAC name of 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid (CID 113246377) is 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid is Cc1nsc(NC(=O)c2ccc(C(=O)O)nc2)n1.
What is the InChIKey of 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid?
The InChIKey is CCDPKCRNVKVAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O3S/c1-5-12-10(18-14-5)13-8(15)6-2-3-7(9(16)17)11-4-6/h2-4H,1H3,(H,16,17)(H,12,13,14,15).
What are the key properties of 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid?
5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid has a molecular weight of 264.27 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 113246377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).