cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone

C16H28N2O — CID 113074947

IUPACcyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCN(C2CCCCCC2)CC1
InChIInChI=1S/C16H28N2O/c19-16(14-6-5-7-14)18-12-10-17(11-13-18)15-8-3-1-2-4-9-15/h14-15H,1-13H2
InChIKeyNXLMSHCOSNEGCD-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.65
Rot. Bonds2

About cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone

cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone (PubChem CID 113074947) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone
PubChem CID113074947
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Namecyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCN(C2CCCCCC2)CC1
InChIInChI=1S/C16H28N2O/c19-16(14-6-5-7-14)18-12-10-17(11-13-18)15-8-3-1-2-4-9-15/h14-15H,1-13H2
InChIKeyNXLMSHCOSNEGCD-UHFFFAOYSA-N
XLogP2.65
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone 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

[4-(4-cyclopentylpiperazine-1-carbonyl)cyclohexyl]-(4-cyclopentylpiperazin-1-yl)methanone
CID 112815528
aziridin-1-yl(cyclohexyl)methanone
CID 2309619
cycloheptyl(pyrrolidin-1-yl)methanone
CID 62778687
cyclohexyl(piperidin-1-yl)methanone
CID 12760854
3-(4-cyclohexylpiperazine-1-carbonyl)bicyclo[3.3.1]nonan-9-one
CID 136515729
(3-aminocyclohexyl)-(4-cyclobutylpiperazin-1-yl)methanone;dihydrochloride
CID 119887153
cyclobutyl-(4-piperidin-3-ylpiperazin-1-yl)methanone
CID 115270016
3-(4-cyclopropylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63782292
(4-cyclobutylpiperazin-1-yl)-[(3R)-pyrrolidin-3-yl]methanone
CID 57463734
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
1-[1-[1-(cyclobutanecarbonyl)piperidin-4-yl]piperidin-4-yl]-1-cyclohexylurea
CID 70308947
4-[4-(cyclohexanecarbonyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120691002

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone?
The IUPAC name of cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone (CID 113074947) is cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone.
What is the SMILES notation for cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone?
The canonical SMILES for cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone is O=C(C1CCC1)N1CCN(C2CCCCCC2)CC1.
What is the InChIKey of cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone?
The InChIKey is NXLMSHCOSNEGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c19-16(14-6-5-7-14)18-12-10-17(11-13-18)15-8-3-1-2-4-9-15/h14-15H,1-13H2.
What are the key properties of cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone?
cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone has a molecular weight of 264.41 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone is sourced from PubChem (CID 113074947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).