N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide

C15H15N3OS — CID 43229184

IUPACN-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)NCCc1nc2ccccc2[nH]1
InChIInChI=1S/C15H15N3OS/c19-15(9-11-6-8-20-10-11)16-7-5-14-17-12-3-1-2-4-13(12)18-14/h1-4,6,8,10H,5,7,9H2,(H,16,19)(H,17,18)
InChIKeyFHPLQOAXRSMCNI-UHFFFAOYSA-N
MW285.37 g/mol
LogP2.53
Rot. Bonds5

About N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide

N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide (PubChem CID 43229184) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide
PubChem CID43229184
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)NCCc1nc2ccccc2[nH]1
InChIInChI=1S/C15H15N3OS/c19-15(9-11-6-8-20-10-11)16-7-5-14-17-12-3-1-2-4-13(12)18-14/h1-4,6,8,10H,5,7,9H2,(H,16,19)(H,17,18)
InChIKeyFHPLQOAXRSMCNI-UHFFFAOYSA-N
XLogP2.53
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 9123515
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
CID 5297042
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-oxobutanamide
CID 110460612
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-thiophen-2-ylpropanamide
CID 17417855
4-[2-(1H-benzimidazol-2-yl)ethylamino]-4-oxobutanoate
CID 6997429
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-ethoxyacetamide
CID 43229187
3-acetamido-N-[2-(1H-benzimidazol-2-yl)ethyl]propanamide
CID 43229201
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 34256999
N-[4-[2-(1H-benzimidazol-2-yl)ethylamino]-4-oxobutyl]benzamide
CID 32757779
benzyl N-[2-[2-(1H-benzimidazol-2-yl)ethylamino]-2-oxoethyl]carbamate
CID 2065366
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 27161588
N-[4-[2-[2-(1H-benzimidazol-2-yl)ethylamino]-2-oxoethyl]-1,3-thiazol-2-yl]pyrimidine-2-carboxamide
CID 146024002

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide (CID 43229184) is N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide is O=C(Cc1ccsc1)NCCc1nc2ccccc2[nH]1.
What is the InChIKey of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide?
The InChIKey is FHPLQOAXRSMCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c19-15(9-11-6-8-20-10-11)16-7-5-14-17-12-3-1-2-4-13(12)18-14/h1-4,6,8,10H,5,7,9H2,(H,16,19)(H,17,18).
What are the key properties of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide?
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide has a molecular weight of 285.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 43229184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).