2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide

C17H16ClN3O2 — CID 110897801

IUPAC2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide
SMILESNC(=O)Cc1nc2ccccc2n1CC(O)c1ccccc1Cl
InChIInChI=1S/C17H16ClN3O2/c18-12-6-2-1-5-11(12)15(22)10-21-14-8-4-3-7-13(14)20-17(21)9-16(19)23/h1-8,15,22H,9-10H2,(H2,19,23)
InChIKeyQFGZRYUAYUVYLB-UHFFFAOYSA-N
MW329.79 g/mol
LogP2.45
Rot. Bonds5

About 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide

2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide (PubChem CID 110897801) has the molecular formula C17H16ClN3O2 and a molecular weight of 329.79 g/mol. Its IUPAC name is 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide
PubChem CID110897801
Molecular FormulaC17H16ClN3O2
Molecular Weight329.79 g/mol
Exact Mass329.09
IUPAC Name2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide
SMILESNC(=O)Cc1nc2ccccc2n1CC(O)c1ccccc1Cl
InChIInChI=1S/C17H16ClN3O2/c18-12-6-2-1-5-11(12)15(22)10-21-14-8-4-3-7-13(14)20-17(21)9-16(19)23/h1-8,15,22H,9-10H2,(H2,19,23)
InChIKeyQFGZRYUAYUVYLB-UHFFFAOYSA-N
XLogP2.45
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.79
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-(2-chlorophenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]ethanol
CID 94379793
1-(2-chlorophenyl)-2-(2-methylbenzimidazol-1-yl)ethanol
CID 47276894
2-[1-[2-(3,4-difluorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide
CID 110897803
N-[(1S)-1-[1-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]ethyl]acetamide
CID 52515056
(1S)-1-(2,5-dichlorophenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]ethanol
CID 94379798
2-(benzotriazol-1-yl)-1-(2-chlorophenyl)ethanol
CID 56837220
2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanol
CID 63105059
2-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]-1-(2-chlorophenyl)ethanol
CID 2858915
N-[(4-chlorophenyl)methyl]-2-[1-[(2R)-2-hydroxy-2-phenylethyl]benzimidazol-2-yl]acetamide
CID 25406903
N-benzyl-2-[1-[(2S)-2-(4-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide
CID 25369283
2-chloro-N-[[1-(2-methylpropyl)benzimidazol-2-yl]methyl]benzamide
CID 17007409
2-[2-(hydroxymethyl)benzimidazol-1-yl]-1-phenylethanol
CID 17479592

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide?
The IUPAC name of 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide (CID 110897801) is 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide.
What is the SMILES notation for 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide?
The canonical SMILES for 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide is NC(=O)Cc1nc2ccccc2n1CC(O)c1ccccc1Cl.
What is the InChIKey of 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide?
The InChIKey is QFGZRYUAYUVYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O2/c18-12-6-2-1-5-11(12)15(22)10-21-14-8-4-3-7-13(14)20-17(21)9-16(19)23/h1-8,15,22H,9-10H2,(H2,19,23).
What are the key properties of 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide?
2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide has a molecular weight of 329.79 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-chlorophenyl)-2-hydroxyethyl]benzimidazol-2-yl]acetamide is sourced from PubChem (CID 110897801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).