N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide

C17H16FN3O — CID 5297042

IUPACN-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCc1nc2ccccc2[nH]1
InChIInChI=1S/C17H16FN3O/c18-13-6-2-1-5-12(13)11-17(22)19-10-9-16-20-14-7-3-4-8-15(14)21-16/h1-8H,9-11H2,(H,19,22)(H,20,21)
InChIKeyWGGBAQHHFDPBAD-UHFFFAOYSA-N
MW297.33 g/mol
LogP2.60
Rot. Bonds5

About N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide

N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide (PubChem CID 5297042) has the molecular formula C17H16FN3O and a molecular weight of 297.33 g/mol. Its IUPAC name is N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
PubChem CID5297042
Molecular FormulaC17H16FN3O
Molecular Weight297.33 g/mol
Exact Mass297.13
IUPAC NameN-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCc1nc2ccccc2[nH]1
InChIInChI=1S/C17H16FN3O/c18-13-6-2-1-5-12(13)11-17(22)19-10-9-16-20-14-7-3-4-8-15(14)21-16/h1-8H,9-11H2,(H,19,22)(H,20,21)
InChIKeyWGGBAQHHFDPBAD-UHFFFAOYSA-N
XLogP2.60
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.33
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 27161588
1-[2-(1H-benzimidazol-2-yl)ethyl]-3-[(2-fluorophenyl)methyl]-2-methylguanidine
CID 111266411
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-oxobutanamide
CID 110460612
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide
CID 43229184
N-[4-[2-(1H-benzimidazol-2-yl)ethylamino]-4-oxobutyl]benzamide
CID 32757779
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3,4,5-trifluorophenoxy)acetamide
CID 59018354
4-[2-(1H-benzimidazol-2-yl)ethylamino]-4-oxobutanoate
CID 6997429
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-ethylphenoxy)acetamide
CID 19175653
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
N-[2-(1H-benzimidazol-2-yl)ethyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 25390328
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-ethoxyacetamide
CID 43229187
4-amino-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
CID 110462612

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide (CID 5297042) is N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide is O=C(Cc1ccccc1F)NCCc1nc2ccccc2[nH]1.
What is the InChIKey of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is WGGBAQHHFDPBAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O/c18-13-6-2-1-5-12(13)11-17(22)19-10-9-16-20-14-7-3-4-8-15(14)21-16/h1-8H,9-11H2,(H,19,22)(H,20,21).
What are the key properties of N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide?
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 297.33 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 5297042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).