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

C10H19NO2 — CID 131423572

IUPAC9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol
SMILESOCC1CCC2(CCOCC2)CN1
InChIInChI=1S/C10H19NO2/c12-7-9-1-2-10(8-11-9)3-5-13-6-4-10/h9,11-12H,1-8H2
InChIKeyKUXXUJMUFVDZEH-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.53
Rot. Bonds1

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

9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol (PubChem CID 131423572) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol.

Molecular Properties

Compound Name9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol
PubChem CID131423572
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol
SMILESOCC1CCC2(CCOCC2)CN1
InChIInChI=1S/C10H19NO2/c12-7-9-1-2-10(8-11-9)3-5-13-6-4-10/h9,11-12H,1-8H2
InChIKeyKUXXUJMUFVDZEH-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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Related Compounds

{7-Azaspiro[4.5]decan-8-yl}methanol
CID 122199538
{5-Azaspiro[2.5]octan-6-yl}methanol
CID 154575242
(3,5-Diethyl-3,4,4,5-tetramethylpiperidin-2-yl)methanol
CID 91077843
7-Azaspiro[3.5]nonan-8-ylmethanol
CID 122643523
3-Methyl-9-oxa-2-azaspiro[5.5]undecane
CID 130118477
[6-(4-Methoxyoxan-4-yl)piperidin-2-yl]methanol
CID 141808339
4-[2-(Hydroxymethyl)piperidin-4-yl]oxan-4-ol
CID 141808342
4-[6-(Hydroxymethyl)piperidin-2-yl]oxan-4-ol
CID 141821612
7-Azoniaspiro[3.5]nonan-8-ylmethanol
CID 163482447
[(6S)-5-azaspiro[2.5]octan-6-yl]methanol
CID 168931552
2-Oxa-9-azaspiro[5.5]undecan-3-ylmethanol
CID 171485212
(2-Propan-2-yl-9-oxa-2-azaspiro[5.5]undecan-3-yl)methanol
CID 177955220

Frequently Asked Questions

What is the IUPAC name of 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol?
The IUPAC name of 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol (CID 131423572) is 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol.
What is the SMILES notation for 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol?
The canonical SMILES for 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol is OCC1CCC2(CCOCC2)CN1.
What is the InChIKey of 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol?
The InChIKey is KUXXUJMUFVDZEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c12-7-9-1-2-10(8-11-9)3-5-13-6-4-10/h9,11-12H,1-8H2.
What are the key properties of 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol?
9-oxa-2-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 9-oxa-2-azaspiro[5.5]undecan-3-ylmethanol is sourced from PubChem (CID 131423572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).