3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide

C14H13N3OS — CID 112527462

IUPAC3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)Nc1ccc2c(c1)ncn2C
InChIInChI=1S/C14H13N3OS/c1-9-5-6-19-13(9)14(18)16-10-3-4-12-11(7-10)15-8-17(12)2/h3-8H,1-2H3,(H,16,18)
InChIKeyRHSWXYOVUWYXGL-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.20
Rot. Bonds2

About 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide

3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide (PubChem CID 112527462) has the molecular formula C14H13N3OS and a molecular weight of 271.34 g/mol. Its IUPAC name is 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide
PubChem CID112527462
Molecular FormulaC14H13N3OS
Molecular Weight271.34 g/mol
Exact Mass271.08
IUPAC Name3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)Nc1ccc2c(c1)ncn2C
InChIInChI=1S/C14H13N3OS/c1-9-5-6-19-13(9)14(18)16-10-3-4-12-11(7-10)15-8-17(12)2/h3-8H,1-2H3,(H,16,18)
InChIKeyRHSWXYOVUWYXGL-UHFFFAOYSA-N
XLogP3.20
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-benzothiazol-5-yl)-3-methylthiophene-2-carboxamide
CID 112525687
(1-methylbenzimidazol-5-yl)urea
CID 12521213
3-methyl-N-pyridin-4-ylthiophene-2-carboxamide
CID 30388319
N-(1-methylbenzimidazol-5-yl)-2-oxopropanamide
CID 115175378
N-(1-methylbenzimidazol-5-yl)-4-(trifluoromethyl)benzamide
CID 110728545
N-[3-(1,7-dimethyl-2-oxo-1,6-naphthyridin-3-yl)-4-methylphenyl]-3-methylthiophene-2-carboxamide
CID 59212300
N-(3-amino-4-methylphenyl)-3-methylthiophene-2-carboxamide
CID 24690358
N-(1-methylbenzimidazol-5-yl)pyridine-3-carboxamide;hydrochloride
CID 110779100
N-(1-methylbenzimidazol-5-yl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 71700995
N-(1-methylbenzimidazol-5-yl)cyclopropanecarboxamide
CID 110728508
N-(4-hydroxyphenyl)-3-methylthiophene-2-carboxamide
CID 28739515
N-(4-iodophenyl)-3-methylthiophene-2-carboxamide
CID 7927248

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide?
The IUPAC name of 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide (CID 112527462) is 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide is Cc1ccsc1C(=O)Nc1ccc2c(c1)ncn2C.
What is the InChIKey of 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide?
The InChIKey is RHSWXYOVUWYXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-9-5-6-19-13(9)14(18)16-10-3-4-12-11(7-10)15-8-17(12)2/h3-8H,1-2H3,(H,16,18).
What are the key properties of 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide?
3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide has a molecular weight of 271.34 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-methylbenzimidazol-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 112527462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).