8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one

C24H34N2O — CID 11245541

IUPAC8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)=CC1(N2CCC3(CC2)C(=O)NCC3c2ccccc2)CCCCC1
InChIInChI=1S/C24H34N2O/c1-19(2)17-23(11-7-4-8-12-23)26-15-13-24(14-16-26)21(18-25-22(24)27)20-9-5-3-6-10-20/h3,5-6,9-10,17,21H,4,7-8,11-16,18H2,1-2H3,(H,25,27)
InChIKeyYGUWHZGNNDRWKA-UHFFFAOYSA-N
MW366.55 g/mol
LogP4.65
Rot. Bonds3

About 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one

8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 11245541) has the molecular formula C24H34N2O and a molecular weight of 366.55 g/mol. Its IUPAC name is 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
PubChem CID11245541
Molecular FormulaC24H34N2O
Molecular Weight366.55 g/mol
Exact Mass366.27
IUPAC Name8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)=CC1(N2CCC3(CC2)C(=O)NCC3c2ccccc2)CCCCC1
InChIInChI=1S/C24H34N2O/c1-19(2)17-23(11-7-4-8-12-23)26-15-13-24(14-16-26)21(18-25-22(24)27)20-9-5-3-6-10-20/h3,5-6,9-10,17,21H,4,7-8,11-16,18H2,1-2H3,(H,25,27)
InChIKeyYGUWHZGNNDRWKA-UHFFFAOYSA-N
XLogP4.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.55
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one 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 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one (CID 11245541) is 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one is CC(C)=CC1(N2CCC3(CC2)C(=O)NCC3c2ccccc2)CCCCC1.
What is the InChIKey of 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is YGUWHZGNNDRWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N2O/c1-19(2)17-23(11-7-4-8-12-23)26-15-13-24(14-16-26)21(18-25-22(24)27)20-9-5-3-6-10-20/h3,5-6,9-10,17,21H,4,7-8,11-16,18H2,1-2H3,(H,25,27).
What are the key properties of 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 366.55 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[1-(2-methylprop-1-enyl)cyclohexyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 11245541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).