2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone

C21H35N3O2 — CID 24719805

IUPAC2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone
SMILESO=C(C1CCC1)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1
InChIInChI=1S/C21H35N3O2/c25-20(18-9-6-10-18)24-15-13-22(14-16-24)19(17-7-2-3-8-17)21(26)23-11-4-1-5-12-23/h17-19H,1-16H2
InChIKeyIXOLLAIWPVHCGT-UHFFFAOYSA-N
MW361.53 g/mol
LogP2.50
Rot. Bonds4

About 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone

2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone (PubChem CID 24719805) has the molecular formula C21H35N3O2 and a molecular weight of 361.53 g/mol. Its IUPAC name is 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone
PubChem CID24719805
Molecular FormulaC21H35N3O2
Molecular Weight361.53 g/mol
Exact Mass361.27
IUPAC Name2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone
SMILESO=C(C1CCC1)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1
InChIInChI=1S/C21H35N3O2/c25-20(18-9-6-10-18)24-15-13-22(14-16-24)19(17-7-2-3-8-17)21(26)23-11-4-1-5-12-23/h17-19H,1-16H2
InChIKeyIXOLLAIWPVHCGT-UHFFFAOYSA-N
XLogP2.50
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.53
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone 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

2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-methylacetamide
CID 24719259
4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)-N-prop-2-enylpiperazine-1-carboxamide
CID 46027291
aziridin-1-yl(cyclohexyl)methanone
CID 2309619
cycloheptyl(pyrrolidin-1-yl)methanone
CID 62778687
cyclohexyl(piperidin-1-yl)methanone
CID 12760854
1-[4-(1-cyclopentyl-2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-methylbutan-1-one
CID 24719217
2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone
CID 46023982
2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-[2-(dimethylamino)ethyl]acetamide
CID 24719226
(2S)-2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-prop-2-enylacetamide
CID 93210191
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-prop-2-enylacetamide
CID 24716536
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
(2R)-N-(4-chlorophenyl)-2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentylacetamide
CID 93221645

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone?
The IUPAC name of 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone (CID 24719805) is 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone?
The canonical SMILES for 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone is O=C(C1CCC1)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1.
What is the InChIKey of 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone?
The InChIKey is IXOLLAIWPVHCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N3O2/c25-20(18-9-6-10-18)24-15-13-22(14-16-24)19(17-7-2-3-8-17)21(26)23-11-4-1-5-12-23/h17-19H,1-16H2.
What are the key properties of 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone?
2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone has a molecular weight of 361.53 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone is sourced from PubChem (CID 24719805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).