2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide

C20H23N3O — CID 78761759

IUPAC2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide
SMILESCC(C)(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21
InChIInChI=1S/C20H23N3O/c1-20(2,3)23(13-16-9-5-4-6-10-16)19(24)14-22-15-21-17-11-7-8-12-18(17)22/h4-12,15H,13-14H2,1-3H3
InChIKeyRGSXPAITPZGGJX-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.86
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide

2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide (PubChem CID 78761759) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide
PubChem CID78761759
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide
SMILESCC(C)(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21
InChIInChI=1S/C20H23N3O/c1-20(2,3)23(13-16-9-5-4-6-10-16)19(24)14-22-15-21-17-11-7-8-12-18(17)22/h4-12,15H,13-14H2,1-3H3
InChIKeyRGSXPAITPZGGJX-UHFFFAOYSA-N
XLogP3.86
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide
CID 16994989
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-N-tert-butyl-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 18195203
N-benzhydryl-2-(benzimidazol-1-yl)-N-methylacetamide
CID 166182166
2-(benzotriazol-1-yloxy)-N-benzyl-N-tert-butylacetamide
CID 35932817
N-benzyl-N-tert-butyl-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]acetamide
CID 51142202
N-(3-aminopropyl)-2-(benzimidazol-1-yl)-N-methylacetamide
CID 43253838
2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide
CID 856407
2-(benzimidazol-1-yl)-N-ethyl-N-(pyridin-2-ylmethyl)acetamide
CID 166221588
2-(benzimidazol-1-yl)-N-[benzyl(methyl)sulfamoyl]-N-methylethanamine
CID 146040289
N-benzyl-N-tert-butyl-2-piperazin-1-ylacetamide
CID 54773454

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide (CID 78761759) is 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide is CC(C)(C)N(Cc1ccccc1)C(=O)Cn1cnc2ccccc21.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide?
The InChIKey is RGSXPAITPZGGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-20(2,3)23(13-16-9-5-4-6-10-16)19(24)14-22-15-21-17-11-7-8-12-18(17)22/h4-12,15H,13-14H2,1-3H3.
What are the key properties of 2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide?
2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide has a molecular weight of 321.42 g/mol, XLogP of 3.86, 4 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-tert-butylacetamide is sourced from PubChem (CID 78761759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).