10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one

C13H21NO — CID 142434215

IUPAC10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one
SMILESCCCN1CCCC12C(=O)CCC=C2C
InChIInChI=1S/C13H21NO/c1-3-9-14-10-5-8-13(14)11(2)6-4-7-12(13)15/h6H,3-5,7-10H2,1-2H3
InChIKeyDCTZXRJEAGZWRJ-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.54
Rot. Bonds2

About 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one

10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one (PubChem CID 142434215) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one.

Molecular Properties

Compound Name10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one
PubChem CID142434215
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one
SMILESCCCN1CCCC12C(=O)CCC=C2C
InChIInChI=1S/C13H21NO/c1-3-9-14-10-5-8-13(14)11(2)6-4-7-12(13)15/h6H,3-5,7-10H2,1-2H3
InChIKeyDCTZXRJEAGZWRJ-UHFFFAOYSA-N
XLogP2.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-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 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one?
The IUPAC name of 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one (CID 142434215) is 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one.
What is the SMILES notation for 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one?
The canonical SMILES for 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one is CCCN1CCCC12C(=O)CCC=C2C.
What is the InChIKey of 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one?
The InChIKey is DCTZXRJEAGZWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-9-14-10-5-8-13(14)11(2)6-4-7-12(13)15/h6H,3-5,7-10H2,1-2H3.
What are the key properties of 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one?
10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one has a molecular weight of 207.32 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-1-propyl-1-azaspiro[4.5]dec-9-en-6-one is sourced from PubChem (CID 142434215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).