N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide

C12H9N3OS — CID 1088934

IUPACN-(1H-benzimidazol-2-yl)thiophene-2-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1cccs1
InChIInChI=1S/C12H9N3OS/c16-11(10-6-3-7-17-10)15-12-13-8-4-1-2-5-9(8)14-12/h1-7H,(H2,13,14,15,16)
InChIKeyCVWNRLYSTJFZAE-UHFFFAOYSA-N
MW243.29 g/mol
LogP2.88
Rot. Bonds2

About N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide

N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide (PubChem CID 1088934) has the molecular formula C12H9N3OS and a molecular weight of 243.29 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)thiophene-2-carboxamide
PubChem CID1088934
Molecular FormulaC12H9N3OS
Molecular Weight243.29 g/mol
Exact Mass243.05
IUPAC NameN-(1H-benzimidazol-2-yl)thiophene-2-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1cccs1
InChIInChI=1S/C12H9N3OS/c16-11(10-6-3-7-17-10)15-12-13-8-4-1-2-5-9(8)14-12/h1-7H,(H2,13,14,15,16)
InChIKeyCVWNRLYSTJFZAE-UHFFFAOYSA-N
XLogP2.88
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 4122
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2-(1H-Benzimidazol-2-yl)-1-(2-thienyl)ethanone
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4-(1H-benzimidazol-2-ylsulfanyl)butanamide
CID 2108955
N-(1-propyl-5-benzimidazolyl)-2-thiophenecarboxamide
CID 828719
N-(1H-benzimidazol-2-yl)-3-methylthiophene-2-carboxamide
CID 2084198
N-(1H-benzimidazol-2-yl)-2-methylsulfanylbenzamide
CID 2473752
(2-Aminobenzimidazol-1-yl)-thiophen-2-ylmethanone;hydrochloride
CID 16195176
2-(1H-benzimidazol-2-ylthio)-1-thiophen-2-ylethanone
CID 574171
N-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxamide
CID 652748
N-[4-(5-methyl-1H-benzimidazol-2-yl)phenyl]-2-(2-thienyl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide (CID 1088934) is N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide is O=C(Nc1nc2ccccc2[nH]1)c1cccs1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide?
The InChIKey is CVWNRLYSTJFZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3OS/c16-11(10-6-3-7-17-10)15-12-13-8-4-1-2-5-9(8)14-12/h1-7H,(H2,13,14,15,16).
What are the key properties of N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide?
N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide has a molecular weight of 243.29 g/mol, XLogP of 2.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 1088934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).