N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide

C18H25N3O2 — CID 16577165

IUPACN-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide
SMILESCCn1c(=O)n(CC(=O)N(C)C2CCCCC2)c2ccccc21
InChIInChI=1S/C18H25N3O2/c1-3-20-15-11-7-8-12-16(15)21(18(20)23)13-17(22)19(2)14-9-5-4-6-10-14/h7-8,11-12,14H,3-6,9-10,13H2,1-2H3
InChIKeyFQYYGVJQGOLNKV-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.61
Rot. Bonds4

About N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide

N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide (PubChem CID 16577165) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide
PubChem CID16577165
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide
SMILESCCn1c(=O)n(CC(=O)N(C)C2CCCCC2)c2ccccc21
InChIInChI=1S/C18H25N3O2/c1-3-20-15-11-7-8-12-16(15)21(18(20)23)13-17(22)19(2)14-9-5-4-6-10-14/h7-8,11-12,14H,3-6,9-10,13H2,1-2H3
InChIKeyFQYYGVJQGOLNKV-UHFFFAOYSA-N
XLogP2.61
TPSA47.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methyl-N-piperidin-4-ylacetamide;hydrochloride
CID 119442893
2-(3-butyl-2,4-dioxothieno[3,2-d]pyrimidin-1-yl)-N-cyclohexyl-N-methylacetamide
CID 46923206
N-cyclohexyl-N-methyl-2-[2-(4-methylphenyl)benzimidazol-1-yl]acetamide
CID 17000965
2-(2-benzylbenzimidazol-1-yl)-N-cyclohexyl-N-methylacetamide
CID 16995633
N-cyclohexyl-N-methyl-2-(4-methyl-1-oxo-[1,2,4]triazolo[4,3-a]benzimidazol-2-yl)acetamide
CID 16676035
N-butyl-N-ethyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 134031593
N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 46554701
N-cyclohexyl-N-methyl-2-[2-(2-phenylethyl)benzimidazol-1-yl]acetamide
CID 16999536
N-cyclopropyl-2-(3-ethyl-2,6-dioxopyrimidin-1-yl)-N-methylacetamide
CID 63810760
N-[3-(dimethylamino)propyl]-N-(1,1-dioxothiolan-3-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 78837683
N-ethyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(2-phenylethyl)acetamide
CID 55587797
[(1S)-2-oxocyclohexyl] 2-(3-ethyl-2-oxobenzimidazol-1-yl)acetate
CID 96997327

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide?
The IUPAC name of N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide (CID 16577165) is N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide?
The canonical SMILES for N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide is CCn1c(=O)n(CC(=O)N(C)C2CCCCC2)c2ccccc21.
What is the InChIKey of N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide?
The InChIKey is FQYYGVJQGOLNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-3-20-15-11-7-8-12-16(15)21(18(20)23)13-17(22)19(2)14-9-5-4-6-10-14/h7-8,11-12,14H,3-6,9-10,13H2,1-2H3.
What are the key properties of N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide?
N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide has a molecular weight of 315.42 g/mol, XLogP of 2.61, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-methylacetamide is sourced from PubChem (CID 16577165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).