2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol

C10H19NO2 — CID 171485212

IUPAC2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol
SMILESOCC1CCC2(CCNCC2)CO1
InChIInChI=1S/C10H19NO2/c12-7-9-1-2-10(8-13-9)3-5-11-6-4-10/h9,11-12H,1-8H2
InChIKeyDCFRJRIKUBPEGT-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.53
Rot. Bonds1

About 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol

2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol (PubChem CID 171485212) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol.

Molecular Properties

Compound Name2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol
PubChem CID171485212
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol
SMILESOCC1CCC2(CCNCC2)CO1
InChIInChI=1S/C10H19NO2/c12-7-9-1-2-10(8-13-9)3-5-11-6-4-10/h9,11-12H,1-8H2
InChIKeyDCFRJRIKUBPEGT-UHFFFAOYSA-N
XLogP0.53
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol?
The IUPAC name of 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol (CID 171485212) is 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol.
What is the SMILES notation for 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol?
The canonical SMILES for 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol is OCC1CCC2(CCNCC2)CO1.
What is the InChIKey of 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol?
The InChIKey is DCFRJRIKUBPEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c12-7-9-1-2-10(8-13-9)3-5-11-6-4-10/h9,11-12H,1-8H2.
What are the key properties of 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol?
2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol has a molecular weight of 185.27 g/mol, XLogP of 0.53, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxa-9-azaspiro[5.5]undecan-3-ylmethanol is sourced from PubChem (CID 171485212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).