1-oxa-9-azaspiro[5.5]undecan-4-ol

C9H17NO2 — CID 56760832

IUPAC1-oxa-9-azaspiro[5.5]undecan-4-ol
SMILESOC1CCOC2(CCNCC2)C1
InChIInChI=1S/C9H17NO2/c11-8-1-6-12-9(7-8)2-4-10-5-3-9/h8,10-11H,1-7H2
InChIKeyLDDNCHISFWVZQK-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.28
Rot. Bonds

About 1-oxa-9-azaspiro[5.5]undecan-4-ol

1-oxa-9-azaspiro[5.5]undecan-4-ol (PubChem CID 56760832) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 1-oxa-9-azaspiro[5.5]undecan-4-ol.

Molecular Properties

Compound Name1-oxa-9-azaspiro[5.5]undecan-4-ol
PubChem CID56760832
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name1-oxa-9-azaspiro[5.5]undecan-4-ol
SMILESOC1CCOC2(CCNCC2)C1
InChIInChI=1S/C9H17NO2/c11-8-1-6-12-9(7-8)2-4-10-5-3-9/h8,10-11H,1-7H2
InChIKeyLDDNCHISFWVZQK-UHFFFAOYSA-N
XLogP0.28
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Oxa-9-azaspiro[5.5]undecane
CID 22975593
{1-Oxa-9-azaspiro[5.5]undecan-2-yl}methanol hydrochloride
CID 178199943
4-(Cyclopropylmethoxy)-1-oxa-9-azaspiro[5.5]undecane
CID 86820393
4-Methoxy-1-oxa-9-azaspiro[5.5]undecane
CID 86820431
(Oxan-4-yl)(piperidin-4-yl)methanol
CID 80560259
3-(1,9-Dioxaspiro[5.5]undecan-4-ylamino)-2,2-difluoropropan-1-ol
CID 106176815
[4-(tetrahydro-2H-pyran-2-ylmethyl)piperidin-4-yl]methanol
CID 56738438
4-Ethoxy-1-oxa-9-azaspiro[5.5]undecane
CID 172908781
1-Oxa-9-azaspiro[5.5]undecan-3-ol
CID 21955215
4-(2-Methylpiperidin-2-yl)butane-1,3-diol
CID 53840112
3-Piperidin-3-yl-3-(2-piperidin-3-ylethoxy)propan-1-ol
CID 68887125
(3S)-1-oxa-9-azaspiro[5.5]undecan-3-ol
CID 69559261

Frequently Asked Questions

What is the IUPAC name of 1-oxa-9-azaspiro[5.5]undecan-4-ol?
The IUPAC name of 1-oxa-9-azaspiro[5.5]undecan-4-ol (CID 56760832) is 1-oxa-9-azaspiro[5.5]undecan-4-ol.
What is the SMILES notation for 1-oxa-9-azaspiro[5.5]undecan-4-ol?
The canonical SMILES for 1-oxa-9-azaspiro[5.5]undecan-4-ol is OC1CCOC2(CCNCC2)C1.
What is the InChIKey of 1-oxa-9-azaspiro[5.5]undecan-4-ol?
The InChIKey is LDDNCHISFWVZQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c11-8-1-6-12-9(7-8)2-4-10-5-3-9/h8,10-11H,1-7H2.
What are the key properties of 1-oxa-9-azaspiro[5.5]undecan-4-ol?
1-oxa-9-azaspiro[5.5]undecan-4-ol has a molecular weight of 171.24 g/mol, XLogP of 0.28, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-9-azaspiro[5.5]undecan-4-ol is sourced from PubChem (CID 56760832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).