10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride

C11H22ClNO — CID 121224331

IUPAC10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
SMILESCC1(C)CC2(CCCNC2)CCO1.Cl
InChIInChI=1S/C11H21NO.ClH/c1-10(2)8-11(5-7-13-10)4-3-6-12-9-11;/h12H,3-9H2,1-2H3;1H
InChIKeyFRLKIRSMXDLRQD-UHFFFAOYSA-N
MW219.76 g/mol
LogP2.37
Rot. Bonds

About 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride

10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride (PubChem CID 121224331) has the molecular formula C11H22ClNO and a molecular weight of 219.76 g/mol. Its IUPAC name is 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride.

Molecular Properties

Compound Name10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
PubChem CID121224331
Molecular FormulaC11H22ClNO
Molecular Weight219.76 g/mol
Exact Mass219.14
IUPAC Name10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
SMILESCC1(C)CC2(CCCNC2)CCO1.Cl
InChIInChI=1S/C11H21NO.ClH/c1-10(2)8-11(5-7-13-10)4-3-6-12-9-11;/h12H,3-9H2,1-2H3;1H
InChIKeyFRLKIRSMXDLRQD-UHFFFAOYSA-N
XLogP2.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.76
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride?
The IUPAC name of 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride (CID 121224331) is 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride.
What is the SMILES notation for 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride?
The canonical SMILES for 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride is CC1(C)CC2(CCCNC2)CCO1.Cl.
What is the InChIKey of 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride?
The InChIKey is FRLKIRSMXDLRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO.ClH/c1-10(2)8-11(5-7-13-10)4-3-6-12-9-11;/h12H,3-9H2,1-2H3;1H.
What are the key properties of 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride?
10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride has a molecular weight of 219.76 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-9-oxa-2-azaspiro[5.5]undecane;hydrochloride is sourced from PubChem (CID 121224331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).