2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide

C18H19N3O — CID 17032674

IUPAC2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C18H19N3O/c1-13(2)19-17(22)12-21-16-11-7-6-10-15(16)20-18(21)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,22)
InChIKeyOTZPHXNMHITZPZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.23
Rot. Bonds4

About 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide

2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide (PubChem CID 17032674) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
PubChem CID17032674
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C18H19N3O/c1-13(2)19-17(22)12-21-16-11-7-6-10-15(16)20-18(21)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,22)
InChIKeyOTZPHXNMHITZPZ-UHFFFAOYSA-N
XLogP3.23
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 17032718
2-(2-phenylbenzimidazol-1-yl)acetic acid
CID 619876
2-[2-(1-chloroethyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 43667741
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]propanamide
CID 17029919
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17029637
N-(4-fluorophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 17032697
2-[2-(4-tert-butylphenyl)benzimidazol-1-yl]-N-(2-methylpropyl)acetamide
CID 84571354
2-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]-N-(1-phenylethyl)acetamide
CID 17033004
N-cyclopentyl-2-[2-(3-methylphenyl)benzimidazol-1-yl]acetamide
CID 17032820
2-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 17032004
2-[2-(4-bromophenyl)benzimidazol-1-yl]-N-ethylacetamide
CID 17033254
2-[2-[(4-chlorophenyl)methyl]benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 17032527

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide (CID 17032674) is 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21.
What is the InChIKey of 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide?
The InChIKey is OTZPHXNMHITZPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13(2)19-17(22)12-21-16-11-7-6-10-15(16)20-18(21)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,22).
What are the key properties of 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide?
2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide has a molecular weight of 293.37 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 17032674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).