2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide

C19H21N3O — CID 16994989

IUPAC2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21
InChIInChI=1S/C19H21N3O/c1-15(2)22(12-16-8-4-3-5-9-16)19(23)13-21-14-20-17-10-6-7-11-18(17)21/h3-11,14-15H,12-13H2,1-2H3
InChIKeyGZYCBUGBRMSCFX-UHFFFAOYSA-N
MW307.40 g/mol
LogP3.47
Rot. Bonds5

About 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide

2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide (PubChem CID 16994989) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide
PubChem CID16994989
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21
InChIInChI=1S/C19H21N3O/c1-15(2)22(12-16-8-4-3-5-9-16)19(23)13-21-14-20-17-10-6-7-11-18(17)21/h3-11,14-15H,12-13H2,1-2H3
InChIKeyGZYCBUGBRMSCFX-UHFFFAOYSA-N
XLogP3.47
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide
CID 78761759
N-benzyl-2-(7-fluoro-4-oxoquinazolin-3-yl)-N-propan-2-ylacetamide
CID 40743682
N-benzhydryl-2-(benzimidazol-1-yl)-N-methylacetamide
CID 166182166
2-(benzimidazol-1-yl)-N-benzyl-N-(oxetan-3-yl)acetamide
CID 166259805
[2-(dibenzylamino)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 2476612
N-benzyl-2-(1-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)-N-propan-2-ylacetamide
CID 27559502
2-[2-(acetamidomethyl)benzimidazol-1-yl]-N-benzyl-N-propan-2-ylacetamide
CID 17006031
N-benzyl-2-[2-(4-chlorophenyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 17001117
N-[[1-[2-[benzyl(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]-2-methylpropanamide
CID 17006337
N-(3-aminopropyl)-2-(benzimidazol-1-yl)-N-methylacetamide
CID 43253838
(2R)-3-(benzimidazol-1-yl)-2-methylpropanoic acid
CID 806595
N-benzyl-2-[2-(naphthalen-1-yloxymethyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 16999447

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide (CID 16994989) is 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide is CC(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide?
The InChIKey is GZYCBUGBRMSCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-15(2)22(12-16-8-4-3-5-9-16)19(23)13-21-14-20-17-10-6-7-11-18(17)21/h3-11,14-15H,12-13H2,1-2H3.
What are the key properties of 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide?
2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide has a molecular weight of 307.40 g/mol, XLogP of 3.47, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide is sourced from PubChem (CID 16994989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).