N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide

C19H15N3OS — CID 58191602

IUPACN-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2csc(-c3nc4ccccc4[nH]3)c2)c1
InChIInChI=1S/C19H15N3OS/c1-12-5-4-6-13(9-12)19(23)20-14-10-17(24-11-14)18-21-15-7-2-3-8-16(15)22-18/h2-11H,1H3,(H,20,23)(H,21,22)
InChIKeyGCVJSIGHYKYCPP-UHFFFAOYSA-N
MW333.42 g/mol
LogP4.85
Rot. Bonds3

About N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide

N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide (PubChem CID 58191602) has the molecular formula C19H15N3OS and a molecular weight of 333.42 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide
PubChem CID58191602
Molecular FormulaC19H15N3OS
Molecular Weight333.42 g/mol
Exact Mass333.09
IUPAC NameN-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2csc(-c3nc4ccccc4[nH]3)c2)c1
InChIInChI=1S/C19H15N3OS/c1-12-5-4-6-13(9-12)19(23)20-14-10-17(24-11-14)18-21-15-7-2-3-8-16(15)22-18/h2-11H,1H3,(H,20,23)(H,21,22)
InChIKeyGCVJSIGHYKYCPP-UHFFFAOYSA-N
XLogP4.85
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[2-(1H-benzimidazol-2-yl)phenyl]-1,3,4-oxadiazol-2-yl]-3-methylbenzamide
CID 10524731
N-[3-(1H-benzimidazol-2-yl)phenyl]-3,5-dimethylbenzamide
CID 969400
ethane;3-methyl-N-[4-[6-[(3-methylbenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide
CID 142812938
N-(3-methylphenyl)-2-(5-nitrothiophen-2-yl)-3H-benzimidazole-5-carboxamide
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3-acetamido-N-[3-[3-(1H-benzimidazol-2-yl)phenyl]phenyl]benzamide
CID 44523579
N-(5-methylthiophen-3-yl)benzamide
CID 142100970
N-(3-methylphenyl)-3-oxo-4H-quinoxaline-2-carboxamide
CID 53016080
N-[3-(1H-benzimidazol-2-yl)-4-methylphenyl]-2-oxo-1H-pyridine-4-carboxamide
CID 70967039
[3-[[3-(1H-benzimidazol-2-yl)phenyl]carbamoyl]phenyl] acetate
CID 5058448
N-[3-(5-chloro-6-methyl-1H-benzimidazol-2-yl)phenyl]-3-methylbenzamide
CID 54857921
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-ethylsulfonylbenzamide
CID 7522685
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-(trifluoromethyl)benzamide
CID 4124334

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide (CID 58191602) is N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide.
What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide is Cc1cccc(C(=O)Nc2csc(-c3nc4ccccc4[nH]3)c2)c1.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide?
The InChIKey is GCVJSIGHYKYCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3OS/c1-12-5-4-6-13(9-12)19(23)20-14-10-17(24-11-14)18-21-15-7-2-3-8-16(15)22-18/h2-11H,1H3,(H,20,23)(H,21,22).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide?
N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide has a molecular weight of 333.42 g/mol, XLogP of 4.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)thiophen-3-yl]-3-methylbenzamide is sourced from PubChem (CID 58191602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).