N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide

C18H25N3O — CID 112781129

IUPACN-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCCN(C(=O)Cn1c(C)nc2ccccc21)C1CCCCC1
InChIInChI=1S/C18H25N3O/c1-3-20(15-9-5-4-6-10-15)18(22)13-21-14(2)19-16-11-7-8-12-17(16)21/h7-8,11-12,15H,3-6,9-10,13H2,1-2H3
InChIKeyIJALIVKMSVXASE-UHFFFAOYSA-N
MW299.42 g/mol
LogP3.53
Rot. Bonds4

About N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide

N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide (PubChem CID 112781129) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide
PubChem CID112781129
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC NameN-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCCN(C(=O)Cn1c(C)nc2ccccc21)C1CCCCC1
InChIInChI=1S/C18H25N3O/c1-3-20(15-9-5-4-6-10-15)18(22)13-21-14(2)19-16-11-7-8-12-17(16)21/h7-8,11-12,15H,3-6,9-10,13H2,1-2H3
InChIKeyIJALIVKMSVXASE-UHFFFAOYSA-N
XLogP3.53
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-cyclohexyl-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 16996480
N-benzyl-N-cyclohexyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 16996581
N-cyclopropyl-2-(2-methylbenzimidazol-1-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 71943250
1-(2,6-dimethylpiperidin-1-yl)-2-(2-methylbenzimidazol-1-yl)ethanone
CID 73140279
N-cyclohexyl-N-methyl-2-[2-(4-methylphenyl)benzimidazol-1-yl]acetamide
CID 17000965
N,N-dicyclohexyl-2-[2-(oxolan-2-yl)benzimidazol-1-yl]acetamide
CID 17000129
methyl 4-[1-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]benzimidazol-2-yl]benzoate
CID 129276836
N,N-dicyclohexyl-2-[2-(3-methylfuran-2-yl)benzimidazol-1-yl]acetamide
CID 175289954
N,N-dicyclohexyl-2-[2-(6-methyl-3-pyridinyl)benzimidazol-1-yl]acetamide
CID 175290062
1-(cyclopentylmethyl)-2-methylbenzimidazole
CID 112728278
N,N-dicyclohexyl-2-(2-naphthalen-2-ylbenzimidazol-1-yl)acetamide
CID 174570409
2-(2-methylbenzimidazol-1-yl)acetic acid
CID 75530217

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide (CID 112781129) is N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide is CCN(C(=O)Cn1c(C)nc2ccccc21)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The InChIKey is IJALIVKMSVXASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-3-20(15-9-5-4-6-10-15)18(22)13-21-14(2)19-16-11-7-8-12-17(16)21/h7-8,11-12,15H,3-6,9-10,13H2,1-2H3.
What are the key properties of N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide?
N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide has a molecular weight of 299.42 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 112781129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).