N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide

C14H23N3O — CID 110203800

IUPACN-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ncc(C)n1C1CCCCC1
InChIInChI=1S/C14H23N3O/c1-11-10-16-14(8-9-15-12(2)18)17(11)13-6-4-3-5-7-13/h10,13H,3-9H2,1-2H3,(H,15,18)
InChIKeyMXTGNIISGOKSDW-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.38
Rot. Bonds4

About N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide

N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide (PubChem CID 110203800) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide
PubChem CID110203800
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ncc(C)n1C1CCCCC1
InChIInChI=1S/C14H23N3O/c1-11-10-16-14(8-9-15-12(2)18)17(11)13-6-4-3-5-7-13/h10,13H,3-9H2,1-2H3,(H,15,18)
InChIKeyMXTGNIISGOKSDW-UHFFFAOYSA-N
XLogP2.38
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide?
The IUPAC name of N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide (CID 110203800) is N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide is CC(=O)NCCc1ncc(C)n1C1CCCCC1.
What is the InChIKey of N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide?
The InChIKey is MXTGNIISGOKSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-11-10-16-14(8-9-15-12(2)18)17(11)13-6-4-3-5-7-13/h10,13H,3-9H2,1-2H3,(H,15,18).
What are the key properties of N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide?
N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide has a molecular weight of 249.36 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-cyclohexyl-5-methylimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110203800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).