4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one

C14H23NO — CID 165467518

IUPAC4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one
SMILESCC1C(=O)NC2(CCCCC2)C1C1CCC1
InChIInChI=1S/C14H23NO/c1-10-12(11-6-5-7-11)14(15-13(10)16)8-3-2-4-9-14/h10-12H,2-9H2,1H3,(H,15,16)
InChIKeyVSZKYCLEUASZDT-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.87
Rot. Bonds1

About 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one

4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one (PubChem CID 165467518) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one
PubChem CID165467518
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one
SMILESCC1C(=O)NC2(CCCCC2)C1C1CCC1
InChIInChI=1S/C14H23NO/c1-10-12(11-6-5-7-11)14(15-13(10)16)8-3-2-4-9-14/h10-12H,2-9H2,1H3,(H,15,16)
InChIKeyVSZKYCLEUASZDT-UHFFFAOYSA-N
XLogP2.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-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 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one?
The IUPAC name of 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one (CID 165467518) is 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one.
What is the SMILES notation for 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one?
The canonical SMILES for 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one is CC1C(=O)NC2(CCCCC2)C1C1CCC1.
What is the InChIKey of 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one?
The InChIKey is VSZKYCLEUASZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-10-12(11-6-5-7-11)14(15-13(10)16)8-3-2-4-9-14/h10-12H,2-9H2,1H3,(H,15,16).
What are the key properties of 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one?
4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one has a molecular weight of 221.34 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-3-methyl-1-azaspiro[4.5]decan-2-one is sourced from PubChem (CID 165467518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).