(5S)-5-hydroxyspiro[5.7]tridecan-13-one

C13H22O2 — CID 134987879

IUPAC(5S)-5-hydroxyspiro[5.7]tridecan-13-one
SMILESO=C1CCCCCCC12CCCC[C@@H]2O
InChIInChI=1S/C13H22O2/c14-11-7-3-1-2-5-9-13(11)10-6-4-8-12(13)15/h12,15H,1-10H2/t12-,13?/m0/s1
InChIKeyVSPHEHXQUHCMSP-UEWDXFNNSA-N
MW210.32 g/mol
LogP2.83
Rot. Bonds

About (5S)-5-hydroxyspiro[5.7]tridecan-13-one

(5S)-5-hydroxyspiro[5.7]tridecan-13-one (PubChem CID 134987879) has the molecular formula C13H22O2 and a molecular weight of 210.32 g/mol. Its IUPAC name is (5S)-5-hydroxyspiro[5.7]tridecan-13-one.

Molecular Properties

Compound Name(5S)-5-hydroxyspiro[5.7]tridecan-13-one
PubChem CID134987879
Molecular FormulaC13H22O2
Molecular Weight210.32 g/mol
Exact Mass210.16
IUPAC Name(5S)-5-hydroxyspiro[5.7]tridecan-13-one
SMILESO=C1CCCCCCC12CCCC[C@@H]2O
InChIInChI=1S/C13H22O2/c14-11-7-3-1-2-5-9-13(11)10-6-4-8-12(13)15/h12,15H,1-10H2/t12-,13?/m0/s1
InChIKeyVSPHEHXQUHCMSP-UEWDXFNNSA-N
XLogP2.83
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5S)-5-hydroxyspiro[5.7]tridecan-13-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

3-Hydroxy-4,4-dimethylcyclohexan-1-one
CID 15706973
(3S)-3-Hydroxy-2,2-dimethylcyclohexan-1-one
CID 11018979
2-Hydroxymethyl-2-methylcyclohexanone
CID 11355532
2-Hydroxy-1-(1-methylcyclohexyl)propan-1-one
CID 85753830
6-Hydroxyspiro[4.5]decan-8-one
CID 137949346
(5S,6R)-5-hydroxyspiro[5.6]dodecan-12-one
CID 25240702
(5S,10S)-10-hydroxyspiro[4.5]decane-4,9-dione
CID 101952389
(5S,6S)-5-hydroxyspiro[5.5]undecane-4,11-dione
CID 101952390
(6S,12S)-12-hydroxyspiro[5.6]dodecane-5,11-dione
CID 101952391
(5S)-5-hydroxyspiro[5.6]dodecan-12-one
CID 134922489
(11S)-11-hydroxyspiro[5.5]undecan-5-one
CID 134987348
(4S)-4-hydroxyspiro[4.7]dodecan-12-one
CID 134987436

Frequently Asked Questions

What is the IUPAC name of (5S)-5-hydroxyspiro[5.7]tridecan-13-one?
The IUPAC name of (5S)-5-hydroxyspiro[5.7]tridecan-13-one (CID 134987879) is (5S)-5-hydroxyspiro[5.7]tridecan-13-one.
What is the SMILES notation for (5S)-5-hydroxyspiro[5.7]tridecan-13-one?
The canonical SMILES for (5S)-5-hydroxyspiro[5.7]tridecan-13-one is O=C1CCCCCCC12CCCC[C@@H]2O.
What is the InChIKey of (5S)-5-hydroxyspiro[5.7]tridecan-13-one?
The InChIKey is VSPHEHXQUHCMSP-UEWDXFNNSA-N. The full InChI is InChI=1S/C13H22O2/c14-11-7-3-1-2-5-9-13(11)10-6-4-8-12(13)15/h12,15H,1-10H2/t12-,13?/m0/s1.
What are the key properties of (5S)-5-hydroxyspiro[5.7]tridecan-13-one?
(5S)-5-hydroxyspiro[5.7]tridecan-13-one has a molecular weight of 210.32 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-hydroxyspiro[5.7]tridecan-13-one is sourced from PubChem (CID 134987879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).