5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide

C15H13N3OS — CID 58284899

IUPAC5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(-n2cnc3ccccc32)s1
InChIInChI=1S/C15H13N3OS/c19-15(17-10-5-6-10)13-7-8-14(20-13)18-9-16-11-3-1-2-4-12(11)18/h1-4,7-10H,5-6H2,(H,17,19)
InChIKeyZBUQTPPDEUAAJJ-UHFFFAOYSA-N
MW283.36 g/mol
LogP2.98
Rot. Bonds3

About 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide

5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide (PubChem CID 58284899) has the molecular formula C15H13N3OS and a molecular weight of 283.36 g/mol. Its IUPAC name is 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide
PubChem CID58284899
Molecular FormulaC15H13N3OS
Molecular Weight283.36 g/mol
Exact Mass283.08
IUPAC Name5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(-n2cnc3ccccc32)s1
InChIInChI=1S/C15H13N3OS/c19-15(17-10-5-6-10)13-7-8-14(20-13)18-9-16-11-3-1-2-4-12(11)18/h1-4,7-10H,5-6H2,(H,17,19)
InChIKeyZBUQTPPDEUAAJJ-UHFFFAOYSA-N
XLogP2.98
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide?
The IUPAC name of 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide (CID 58284899) is 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide.
What is the SMILES notation for 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide?
The canonical SMILES for 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide is O=C(NC1CC1)c1ccc(-n2cnc3ccccc32)s1.
What is the InChIKey of 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide?
The InChIKey is ZBUQTPPDEUAAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS/c19-15(17-10-5-6-10)13-7-8-14(20-13)18-9-16-11-3-1-2-4-12(11)18/h1-4,7-10H,5-6H2,(H,17,19).
What are the key properties of 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide?
5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide has a molecular weight of 283.36 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzimidazol-1-yl)-N-cyclopropylthiophene-2-carboxamide is sourced from PubChem (CID 58284899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).