1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone

C13H24N2O — CID 784031

IUPAC1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C2CCC(C)CC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-3-5-13(6-4-11)15-9-7-14(8-10-15)12(2)16/h11,13H,3-10H2,1-2H3
InChIKeySDCCYOVPPGOLLY-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.73
Rot. Bonds1

About 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone

1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone (PubChem CID 784031) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone
PubChem CID784031
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C2CCC(C)CC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-3-5-13(6-4-11)15-9-7-14(8-10-15)12(2)16/h11,13H,3-10H2,1-2H3
InChIKeySDCCYOVPPGOLLY-UHFFFAOYSA-N
XLogP1.73
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone with MolForge

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

Launch Full Analysis

Related Compounds

Pexantel
CID 667497
1-(4-Cyclohexyl-1-piperazinyl)ethanone
CID 17249095
Piperazine, 1-methyl-4-(2-propylvaleryl)-
CID 211192
1-Piperazineacetamide, N-(4-methylcyclohexyl)-
CID 3048977
1-Cyclohexanecarbonyl-4-ethylpiperazine
CID 798754
N-(4-methylcyclohexyl)-2-(piperazin-1-yl)acetamide
CID 22762711
1-(1-Acetyl-1,4-diazaspiro[5.5]undecan-4-yl)ethanone
CID 8006933
N-methyl-N-(4-methylcyclohexyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]acetamide
CID 75386859
1-[4-(4-Methylpentan-2-yl)piperazin-1-yl]ethanone
CID 132283975
2-(4-acetylpiperazin-1-yl)-N-ethyl-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 49854193
1-[4-(4-Fluorocyclohexyl)piperazin-1-yl]-2-methylpropan-1-one
CID 141692600
N-fluoro-N-[4-[2-[4-(trifluoromethyl)piperazin-1-yl]ethyl]cyclohexyl]acetamide
CID 174574502

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone (CID 784031) is 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone is CC(=O)N1CCN(C2CCC(C)CC2)CC1.
What is the InChIKey of 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone?
The InChIKey is SDCCYOVPPGOLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-11-3-5-13(6-4-11)15-9-7-14(8-10-15)12(2)16/h11,13H,3-10H2,1-2H3.
What are the key properties of 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone?
1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone has a molecular weight of 224.35 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 784031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).