(7S)-7-methyl-6-azaspiro[3.4]octan-5-one

C8H13NO — CID 155819796

IUPAC(7S)-7-methyl-6-azaspiro[3.4]octan-5-one
SMILESC[C@H]1CC2(CCC2)C(=O)N1
InChIInChI=1S/C8H13NO/c1-6-5-8(3-2-4-8)7(10)9-6/h6H,2-5H2,1H3,(H,9,10)/t6-/m0/s1
InChIKeySBWIPEVIJJSOJY-LURJTMIESA-N
MW139.20 g/mol
LogP1.07
Rot. Bonds

About (7S)-7-methyl-6-azaspiro[3.4]octan-5-one

(7S)-7-methyl-6-azaspiro[3.4]octan-5-one (PubChem CID 155819796) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is (7S)-7-methyl-6-azaspiro[3.4]octan-5-one.

Molecular Properties

Compound Name(7S)-7-methyl-6-azaspiro[3.4]octan-5-one
PubChem CID155819796
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name(7S)-7-methyl-6-azaspiro[3.4]octan-5-one
SMILESC[C@H]1CC2(CCC2)C(=O)N1
InChIInChI=1S/C8H13NO/c1-6-5-8(3-2-4-8)7(10)9-6/h6H,2-5H2,1H3,(H,9,10)/t6-/m0/s1
InChIKeySBWIPEVIJJSOJY-LURJTMIESA-N
XLogP1.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (7S)-7-methyl-6-azaspiro[3.4]octan-5-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 (7S)-7-methyl-6-azaspiro[3.4]octan-5-one?
The IUPAC name of (7S)-7-methyl-6-azaspiro[3.4]octan-5-one (CID 155819796) is (7S)-7-methyl-6-azaspiro[3.4]octan-5-one.
What is the SMILES notation for (7S)-7-methyl-6-azaspiro[3.4]octan-5-one?
The canonical SMILES for (7S)-7-methyl-6-azaspiro[3.4]octan-5-one is C[C@H]1CC2(CCC2)C(=O)N1.
What is the InChIKey of (7S)-7-methyl-6-azaspiro[3.4]octan-5-one?
The InChIKey is SBWIPEVIJJSOJY-LURJTMIESA-N. The full InChI is InChI=1S/C8H13NO/c1-6-5-8(3-2-4-8)7(10)9-6/h6H,2-5H2,1H3,(H,9,10)/t6-/m0/s1.
What are the key properties of (7S)-7-methyl-6-azaspiro[3.4]octan-5-one?
(7S)-7-methyl-6-azaspiro[3.4]octan-5-one has a molecular weight of 139.20 g/mol, XLogP of 1.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-7-methyl-6-azaspiro[3.4]octan-5-one is sourced from PubChem (CID 155819796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).