2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide

C17H25N3O — CID 16996472

IUPAC2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C17H25N3O/c1-6-16-18-14-9-7-8-10-15(14)19(16)11-17(21)20(12(2)3)13(4)5/h7-10,12-13H,6,11H2,1-5H3
InChIKeyIDVYLWSDDUNWGP-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.24
Rot. Bonds5

About 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide

2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide (PubChem CID 16996472) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide
PubChem CID16996472
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C17H25N3O/c1-6-16-18-14-9-7-8-10-15(14)19(16)11-17(21)20(12(2)3)13(4)5/h7-10,12-13H,6,11H2,1-5H3
InChIKeyIDVYLWSDDUNWGP-UHFFFAOYSA-N
XLogP3.24
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorobenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide
CID 1448986
N,N-di(butan-2-yl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 16995334
N-[[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]cyclopropanecarboxamide
CID 16969907
N-[3-[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]propyl]-2-ethylbutanamide
CID 16981079
4-chloro-N-[[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]benzamide
CID 17009109
N-[[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]-2-fluorobenzamide
CID 17007857
N-butyl-2-(2-ethylbenzimidazol-1-yl)-N-methylacetamide
CID 16996476
(Z)-N-[[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]-3-phenylprop-2-enamide
CID 16970879
2-[2-[(2,5-dimethylphenoxy)methyl]benzimidazol-1-yl]-N,N-di(propan-2-yl)acetamide
CID 16998038
N-[3-[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]propyl]prop-2-enamide
CID 16986828
N-(cyclohexylmethyl)-2-(2-ethylbenzimidazol-1-yl)-N-methylacetamide
CID 55563675
N-[5-[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]pentyl]-2-methylprop-2-enamide
CID 16992477

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide (CID 16996472) is 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide is CCc1nc2ccccc2n1CC(=O)N(C(C)C)C(C)C.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide?
The InChIKey is IDVYLWSDDUNWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-6-16-18-14-9-7-8-10-15(14)19(16)11-17(21)20(12(2)3)13(4)5/h7-10,12-13H,6,11H2,1-5H3.
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide?
2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide has a molecular weight of 287.41 g/mol, XLogP of 3.24, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide is sourced from PubChem (CID 16996472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).