(6R)-1-oxaspiro[5.5]undecan-11-one

C10H16O2 — CID 125451232

IUPAC(6R)-1-oxaspiro[5.5]undecan-11-one
SMILESO=C1CCCC[C@@]12CCCCO2
InChIInChI=1S/C10H16O2/c11-9-5-1-2-6-10(9)7-3-4-8-12-10/h1-8H2/t10-/m1/s1
InChIKeyBCDUERHIAKXPKD-SNVBAGLBSA-N
MW168.24 g/mol
LogP2.07
Rot. Bonds

About (6R)-1-oxaspiro[5.5]undecan-11-one

(6R)-1-oxaspiro[5.5]undecan-11-one (PubChem CID 125451232) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (6R)-1-oxaspiro[5.5]undecan-11-one.

Molecular Properties

Compound Name(6R)-1-oxaspiro[5.5]undecan-11-one
PubChem CID125451232
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(6R)-1-oxaspiro[5.5]undecan-11-one
SMILESO=C1CCCC[C@@]12CCCCO2
InChIInChI=1S/C10H16O2/c11-9-5-1-2-6-10(9)7-3-4-8-12-10/h1-8H2/t10-/m1/s1
InChIKeyBCDUERHIAKXPKD-SNVBAGLBSA-N
XLogP2.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-1-oxaspiro[5.5]undecan-11-one?
The IUPAC name of (6R)-1-oxaspiro[5.5]undecan-11-one (CID 125451232) is (6R)-1-oxaspiro[5.5]undecan-11-one.
What is the SMILES notation for (6R)-1-oxaspiro[5.5]undecan-11-one?
The canonical SMILES for (6R)-1-oxaspiro[5.5]undecan-11-one is O=C1CCCC[C@@]12CCCCO2.
What is the InChIKey of (6R)-1-oxaspiro[5.5]undecan-11-one?
The InChIKey is BCDUERHIAKXPKD-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H16O2/c11-9-5-1-2-6-10(9)7-3-4-8-12-10/h1-8H2/t10-/m1/s1.
What are the key properties of (6R)-1-oxaspiro[5.5]undecan-11-one?
(6R)-1-oxaspiro[5.5]undecan-11-one has a molecular weight of 168.24 g/mol, XLogP of 2.07, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1-oxaspiro[5.5]undecan-11-one is sourced from PubChem (CID 125451232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).