3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione

C17H26N2O2 — CID 115926968

IUPAC3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione
SMILESCN1C2CCC1CC1(CC(=O)NC(=O)C1C1CCCC1)C2
InChIInChI=1S/C17H26N2O2/c1-19-12-6-7-13(19)9-17(8-12)10-14(20)18-16(21)15(17)11-4-2-3-5-11/h11-13,15H,2-10H2,1H3,(H,18,20,21)
InChIKeyZPXLLNAMLYWDDP-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.08
Rot. Bonds1

About 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione

3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione (PubChem CID 115926968) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione.

Molecular Properties

Compound Name3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione
PubChem CID115926968
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione
SMILESCN1C2CCC1CC1(CC(=O)NC(=O)C1C1CCCC1)C2
InChIInChI=1S/C17H26N2O2/c1-19-12-6-7-13(19)9-17(8-12)10-14(20)18-16(21)15(17)11-4-2-3-5-11/h11-13,15H,2-10H2,1H3,(H,18,20,21)
InChIKeyZPXLLNAMLYWDDP-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione 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 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione?
The IUPAC name of 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione (CID 115926968) is 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione.
What is the SMILES notation for 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione?
The canonical SMILES for 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione is CN1C2CCC1CC1(CC(=O)NC(=O)C1C1CCCC1)C2.
What is the InChIKey of 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione?
The InChIKey is ZPXLLNAMLYWDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-19-12-6-7-13(19)9-17(8-12)10-14(20)18-16(21)15(17)11-4-2-3-5-11/h11-13,15H,2-10H2,1H3,(H,18,20,21).
What are the key properties of 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione?
3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione has a molecular weight of 290.41 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-cyclopentyl-8-methylspiro[8-azabicyclo[3.2.1]octane-3,4'-piperidine]-2',6'-dione is sourced from PubChem (CID 115926968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).