9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol

C10H19NO2 — CID 21050546

IUPAC9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol
SMILESCN1CCC2(CCC(O)CO2)CC1
InChIInChI=1S/C10H19NO2/c1-11-6-4-10(5-7-11)3-2-9(12)8-13-10/h9,12H,2-8H2,1H3
InChIKeyQWBZOVDNXPSISN-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.62
Rot. Bonds

About 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol

9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol (PubChem CID 21050546) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol.

Molecular Properties

Compound Name9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol
PubChem CID21050546
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol
SMILESCN1CCC2(CCC(O)CO2)CC1
InChIInChI=1S/C10H19NO2/c1-11-6-4-10(5-7-11)3-2-9(12)8-13-10/h9,12H,2-8H2,1H3
InChIKeyQWBZOVDNXPSISN-UHFFFAOYSA-N
XLogP0.62
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol?
The IUPAC name of 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol (CID 21050546) is 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol.
What is the SMILES notation for 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol?
The canonical SMILES for 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol is CN1CCC2(CCC(O)CO2)CC1.
What is the InChIKey of 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol?
The InChIKey is QWBZOVDNXPSISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-11-6-4-10(5-7-11)3-2-9(12)8-13-10/h9,12H,2-8H2,1H3.
What are the key properties of 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol?
9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol has a molecular weight of 185.27 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-oxa-9-azaspiro[5.5]undecan-3-ol is sourced from PubChem (CID 21050546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).