9-methylspiro[3.5]nonan-3-one

C10H16O — CID 557033

IUPAC9-methylspiro[3.5]nonan-3-one
SMILESCC1CCCCC12CCC2=O
InChIInChI=1S/C10H16O/c1-8-4-2-3-6-10(8)7-5-9(10)11/h8H,2-7H2,1H3
InChIKeyCZWVWMYESMGDLX-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.55
Rot. Bonds

About 9-methylspiro[3.5]nonan-3-one

9-methylspiro[3.5]nonan-3-one (PubChem CID 557033) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 9-methylspiro[3.5]nonan-3-one.

Molecular Properties

Compound Name9-methylspiro[3.5]nonan-3-one
PubChem CID557033
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name9-methylspiro[3.5]nonan-3-one
SMILESCC1CCCCC12CCC2=O
InChIInChI=1S/C10H16O/c1-8-4-2-3-6-10(8)7-5-9(10)11/h8H,2-7H2,1H3
InChIKeyCZWVWMYESMGDLX-UHFFFAOYSA-N
XLogP2.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9-methylspiro[3.5]nonan-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-methylspiro[3.4]octan-3-one
CID 557011
(10R)-10-methylspiro[4.5]decan-4-one
CID 130834325
4-methyl-2-azaspiro[4.5]decan-6-one
CID 165478308
(6S)-11-hydroxyspiro[5.5]undecan-5-one
CID 157212438
(5S,6R)-5-hydroxyspiro[5.6]dodecan-12-one
CID 25240702
(3R,5R)-6-methyl-10-oxospiro[4.5]decane-3-carboxylic acid
CID 102065251
1,8-dimethylspiro[4.5]dec-8-en-4-one
CID 10997609
9-methyl-2-azaspiro[4.4]nonane-1,3-dione
CID 65047131
4-methylspiro[4.5]dec-2-en-10-one
CID 12923988
(4R,8S)-8-[(E,1R)-1-methoxybut-2-enyl]spiro[3.4]octan-3-one
CID 23650127
methyl (3R,5R,6R)-6-methyl-10-oxospiro[4.5]decane-3-carboxylate
CID 135041714
2,6-dimethyl-1-oxaspiro[4.5]decan-4-one
CID 24974113

Frequently Asked Questions

What is the IUPAC name of 9-methylspiro[3.5]nonan-3-one?
The IUPAC name of 9-methylspiro[3.5]nonan-3-one (CID 557033) is 9-methylspiro[3.5]nonan-3-one.
What is the SMILES notation for 9-methylspiro[3.5]nonan-3-one?
The canonical SMILES for 9-methylspiro[3.5]nonan-3-one is CC1CCCCC12CCC2=O.
What is the InChIKey of 9-methylspiro[3.5]nonan-3-one?
The InChIKey is CZWVWMYESMGDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-8-4-2-3-6-10(8)7-5-9(10)11/h8H,2-7H2,1H3.
What are the key properties of 9-methylspiro[3.5]nonan-3-one?
9-methylspiro[3.5]nonan-3-one has a molecular weight of 152.24 g/mol, XLogP of 2.55, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylspiro[3.5]nonan-3-one is sourced from PubChem (CID 557033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).