(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one

C10H17NO2 — CID 10397469

IUPAC(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one
SMILESO=C1NCCC[C@]12CCCC[C@H]2O
InChIInChI=1S/C10H17NO2/c12-8-4-1-2-5-10(8)6-3-7-11-9(10)13/h8,12H,1-7H2,(H,11,13)/t8-,10+/m1/s1
InChIKeyCEZMHNNWOLFNJU-SCZZXKLOSA-N
MW183.25 g/mol
LogP0.82
Rot. Bonds

About (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one

(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one (PubChem CID 10397469) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one.

Molecular Properties

Compound Name(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one
PubChem CID10397469
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one
SMILESO=C1NCCC[C@]12CCCC[C@H]2O
InChIInChI=1S/C10H17NO2/c12-8-4-1-2-5-10(8)6-3-7-11-9(10)13/h8,12H,1-7H2,(H,11,13)/t8-,10+/m1/s1
InChIKeyCEZMHNNWOLFNJU-SCZZXKLOSA-N
XLogP0.82
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one?
The IUPAC name of (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one (CID 10397469) is (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one.
What is the SMILES notation for (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one?
The canonical SMILES for (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one is O=C1NCCC[C@]12CCCC[C@H]2O.
What is the InChIKey of (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one?
The InChIKey is CEZMHNNWOLFNJU-SCZZXKLOSA-N. The full InChI is InChI=1S/C10H17NO2/c12-8-4-1-2-5-10(8)6-3-7-11-9(10)13/h8,12H,1-7H2,(H,11,13)/t8-,10+/m1/s1.
What are the key properties of (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one?
(6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one has a molecular weight of 183.25 g/mol, XLogP of 0.82, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S,11R)-11-hydroxy-2-azaspiro[5.5]undecan-1-one is sourced from PubChem (CID 10397469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).