(4S)-4-hydroxyspiro[4.5]decan-10-one

C10H16O2 — CID 134987677

IUPAC(4S)-4-hydroxyspiro[4.5]decan-10-one
SMILESO=C1CCCCC12CCC[C@@H]2O
InChIInChI=1S/C10H16O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h9,12H,1-7H2/t9-,10?/m0/s1
InChIKeyJQPUCIVFQUYDMU-RGURZIINSA-N
MW168.24 g/mol
LogP1.66
Rot. Bonds

About (4S)-4-hydroxyspiro[4.5]decan-10-one

(4S)-4-hydroxyspiro[4.5]decan-10-one (PubChem CID 134987677) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (4S)-4-hydroxyspiro[4.5]decan-10-one.

Molecular Properties

Compound Name(4S)-4-hydroxyspiro[4.5]decan-10-one
PubChem CID134987677
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(4S)-4-hydroxyspiro[4.5]decan-10-one
SMILESO=C1CCCCC12CCC[C@@H]2O
InChIInChI=1S/C10H16O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h9,12H,1-7H2/t9-,10?/m0/s1
InChIKeyJQPUCIVFQUYDMU-RGURZIINSA-N
XLogP1.66
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-hydroxyspiro[4.5]decan-10-one?
The IUPAC name of (4S)-4-hydroxyspiro[4.5]decan-10-one (CID 134987677) is (4S)-4-hydroxyspiro[4.5]decan-10-one.
What is the SMILES notation for (4S)-4-hydroxyspiro[4.5]decan-10-one?
The canonical SMILES for (4S)-4-hydroxyspiro[4.5]decan-10-one is O=C1CCCCC12CCC[C@@H]2O.
What is the InChIKey of (4S)-4-hydroxyspiro[4.5]decan-10-one?
The InChIKey is JQPUCIVFQUYDMU-RGURZIINSA-N. The full InChI is InChI=1S/C10H16O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h9,12H,1-7H2/t9-,10?/m0/s1.
What are the key properties of (4S)-4-hydroxyspiro[4.5]decan-10-one?
(4S)-4-hydroxyspiro[4.5]decan-10-one has a molecular weight of 168.24 g/mol, XLogP of 1.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-hydroxyspiro[4.5]decan-10-one is sourced from PubChem (CID 134987677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).