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

C12H8ClN3OS — CID 60735598

IUPAC5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)c1ccc(Cl)s1
InChIInChI=1S/C12H8ClN3OS/c13-10-6-5-9(18-10)12(17)14-11-7-3-1-2-4-8(7)15-16-11/h1-6H,(H2,14,15,16,17)
InChIKeyYBOLBHUDKJBFSH-UHFFFAOYSA-N
MW277.74 g/mol
LogP3.53
Rot. Bonds2

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

5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide (PubChem CID 60735598) has the molecular formula C12H8ClN3OS and a molecular weight of 277.74 g/mol. Its IUPAC name is 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide
PubChem CID60735598
Molecular FormulaC12H8ClN3OS
Molecular Weight277.74 g/mol
Exact Mass277.01
IUPAC Name5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)c1ccc(Cl)s1
InChIInChI=1S/C12H8ClN3OS/c13-10-6-5-9(18-10)12(17)14-11-7-3-1-2-4-8(7)15-16-11/h1-6H,(H2,14,15,16,17)
InChIKeyYBOLBHUDKJBFSH-UHFFFAOYSA-N
XLogP3.53
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.74
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(1H-indazol-3-yl)benzamide
CID 12913046
2,5-dichloro-N-(1H-indazol-3-yl)benzamide
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5-chloro-N-(2-methyl-1H-indol-3-yl)thiophene-2-carboxamide
CID 112527047
N-(1H-indazol-3-yl)pyrazine-2-carboxamide
CID 60729729
N-(1H-indazol-3-yl)-6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-carboxamide
CID 80711433
5-bromo-N-(1H-indazol-3-yl)pyrazine-2-carboxamide
CID 112527831
N-(1H-indazol-3-yl)prop-2-enamide
CID 62686025
N-(1H-indazol-3-yl)-3-methylfuran-2-carboxamide
CID 60730334
2-amino-N-(1H-indazol-3-yl)acetamide;hydrochloride
CID 130729532
N-(1H-indazol-3-yl)-2-piperidin-1-ylbenzamide
CID 126622679
N-(1H-indazol-3-yl)-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 61068182
N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide
CID 62686015

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide (CID 60735598) is 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide is O=C(Nc1n[nH]c2ccccc12)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide?
The InChIKey is YBOLBHUDKJBFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3OS/c13-10-6-5-9(18-10)12(17)14-11-7-3-1-2-4-8(7)15-16-11/h1-6H,(H2,14,15,16,17).
What are the key properties of 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide?
5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide has a molecular weight of 277.74 g/mol, XLogP of 3.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 60735598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).