3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide

C9H8ClN3OS — CID 80641240

IUPAC3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2sccc2Cl)n[nH]1
InChIInChI=1S/C9H8ClN3OS/c1-5-4-7(13-12-5)11-9(14)8-6(10)2-3-15-8/h2-4H,1H3,(H2,11,12,13,14)
InChIKeyUGOSQRYTAUZREN-UHFFFAOYSA-N
MW241.70 g/mol
LogP2.69
Rot. Bonds2

About 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide

3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide (PubChem CID 80641240) has the molecular formula C9H8ClN3OS and a molecular weight of 241.70 g/mol. Its IUPAC name is 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
PubChem CID80641240
Molecular FormulaC9H8ClN3OS
Molecular Weight241.70 g/mol
Exact Mass241.01
IUPAC Name3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2sccc2Cl)n[nH]1
InChIInChI=1S/C9H8ClN3OS/c1-5-4-7(13-12-5)11-9(14)8-6(10)2-3-15-8/h2-4H,1H3,(H2,11,12,13,14)
InChIKeyUGOSQRYTAUZREN-UHFFFAOYSA-N
XLogP2.69
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.70
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
CID 47148561
2-amino-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 63823171
3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 55031730
4-chloro-N-(5-methyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 103872553
2-N,6-N-bis(5-methyl-1H-pyrazol-3-yl)pyridine-2,6-dicarboxamide
CID 12073846
2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 47289778
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
2-amino-4-methyl-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
CID 63822437
2-[(4-methoxybenzoyl)amino]-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 84550600
5-amino-N-(5-methyl-1H-pyrazol-3-yl)pyridine-2-carboxamide
CID 81316584
N-(4-amino-3-methylphenyl)-3-chlorothiophene-2-carboxamide
CID 80644262
3-chloro-N-(4-hydroxy-2-methylphenyl)thiophene-2-carboxamide
CID 80641212

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide (CID 80641240) is 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide is Cc1cc(NC(=O)c2sccc2Cl)n[nH]1.
What is the InChIKey of 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The InChIKey is UGOSQRYTAUZREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3OS/c1-5-4-7(13-12-5)11-9(14)8-6(10)2-3-15-8/h2-4H,1H3,(H2,11,12,13,14).
What are the key properties of 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide has a molecular weight of 241.70 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 80641240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).