1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride

C10H20ClNO2 — CID 178199943

IUPAC1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride
SMILESCl.OCC1CCCC2(CCNCC2)O1
InChIInChI=1S/C10H19NO2.ClH/c12-8-9-2-1-3-10(13-9)4-6-11-7-5-10;/h9,11-12H,1-8H2;1H
InChIKeyQCDYCIIXBMCBQB-UHFFFAOYSA-N
MW221.73 g/mol
LogP1.09
Rot. Bonds1

About 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride

1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride (PubChem CID 178199943) has the molecular formula C10H20ClNO2 and a molecular weight of 221.73 g/mol. Its IUPAC name is 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride.

Molecular Properties

Compound Name1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride
PubChem CID178199943
Molecular FormulaC10H20ClNO2
Molecular Weight221.73 g/mol
Exact Mass221.12
IUPAC Name1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride
SMILESCl.OCC1CCCC2(CCNCC2)O1
InChIInChI=1S/C10H19NO2.ClH/c12-8-9-2-1-3-10(13-9)4-6-11-7-5-10;/h9,11-12H,1-8H2;1H
InChIKeyQCDYCIIXBMCBQB-UHFFFAOYSA-N
XLogP1.09
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride?
The IUPAC name of 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride (CID 178199943) is 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride.
What is the SMILES notation for 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride?
The canonical SMILES for 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride is Cl.OCC1CCCC2(CCNCC2)O1.
What is the InChIKey of 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride?
The InChIKey is QCDYCIIXBMCBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.ClH/c12-8-9-2-1-3-10(13-9)4-6-11-7-5-10;/h9,11-12H,1-8H2;1H.
What are the key properties of 1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride?
1-oxa-9-azaspiro[5.5]undecan-2-ylmethanol;hydrochloride has a molecular weight of 221.73 g/mol, XLogP of 1.09, 1 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-2-ylmethanol;hydrochloride is sourced from PubChem (CID 178199943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).