N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide

C14H13N3OS — CID 51091236

IUPACN-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCn1cnc2ccccc21)c1cccs1
InChIInChI=1S/C14H13N3OS/c18-14(13-6-3-9-19-13)15-7-8-17-10-16-11-4-1-2-5-12(11)17/h1-6,9-10H,7-8H2,(H,15,18)
InChIKeyHPDHSHOFSWCLIC-UHFFFAOYSA-N
MW271.35 g/mol
LogP2.53
Rot. Bonds4

About N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide

N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide (PubChem CID 51091236) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide
PubChem CID51091236
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC NameN-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCn1cnc2ccccc21)c1cccs1
InChIInChI=1S/C14H13N3OS/c18-14(13-6-3-9-19-13)15-7-8-17-10-16-11-4-1-2-5-12(11)17/h1-6,9-10H,7-8H2,(H,15,18)
InChIKeyHPDHSHOFSWCLIC-UHFFFAOYSA-N
XLogP2.53
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[3-(benzimidazol-1-yl)propylamino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide
CID 51222009
N-[2-(benzimidazol-1-yl)ethyl]butanamide
CID 47404733
N-[3-(benzimidazol-1-yl)propyl]-2,6-difluorobenzamide
CID 86912487
N-[2-(benzimidazol-1-yl)ethyl]-2-(4-fluorophenyl)acetamide
CID 47929228
N-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]thiophene-2-carboxamide
CID 86266129
N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]thiophene-2-carboxamide
CID 121121088
N-[4-[2-[2-(benzimidazol-1-yl)ethylamino]-2-oxoethyl]-1,3-thiazol-2-yl]-2-methylpropanamide
CID 47928469
N-[2-(1-propylbenzimidazol-2-yl)ethyl]thiophene-2-carboxamide
CID 751300
N-[2-(benzimidazol-1-yl)ethyl]-1-propan-2-ylindole-3-carboxamide
CID 71705073
5-[3-(benzimidazol-1-yl)propylamino]-5-oxo-3-thiophen-2-ylpentanoic acid
CID 91953280
N-[2-(benzimidazol-1-yl)ethyl]-2,4-dimethoxybenzamide
CID 47069219
N-[2-[1-(2-phenoxyethyl)benzimidazol-2-yl]ethyl]thiophene-2-carboxamide
CID 16975607

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide (CID 51091236) is N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide is O=C(NCCn1cnc2ccccc21)c1cccs1.
What is the InChIKey of N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is HPDHSHOFSWCLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c18-14(13-6-3-9-19-13)15-7-8-17-10-16-11-4-1-2-5-12(11)17/h1-6,9-10H,7-8H2,(H,15,18).
What are the key properties of N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide?
N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 271.35 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzimidazol-1-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 51091236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).