1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane

C11H21NO — CID 122598907

IUPAC1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane
SMILESCC1CCOCC12CCCCN2C
InChIInChI=1S/C11H21NO/c1-10-5-8-13-9-11(10)6-3-4-7-12(11)2/h10H,3-9H2,1-2H3
InChIKeyTVPCAWZGPFOUBC-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds

About 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane

1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane (PubChem CID 122598907) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane.

Molecular Properties

Compound Name1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane
PubChem CID122598907
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane
SMILESCC1CCOCC12CCCCN2C
InChIInChI=1S/C11H21NO/c1-10-5-8-13-9-11(10)6-3-4-7-12(11)2/h10H,3-9H2,1-2H3
InChIKeyTVPCAWZGPFOUBC-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(6S,11S)-1,11-diethyl-8-oxa-1-azaspiro[5.5]undecane
CID 122597278
(4R)-1-ethyl-4-methyl-7-oxa-1-azaspiro[4.4]nonane
CID 152875103
1-methyl-9-propan-2-yloxy-7-oxa-1-azaspiro[4.4]nonane
CID 177126154
(11S)-6-iodo-11-methyl-6-azaspiro[4.6]undecane
CID 145095318
ethane;3,3,4-trimethyloxane
CID 145166291
(1-methyl-1,9-diazaspiro[5.5]undecan-9-yl)-(oxan-4-yl)methanone
CID 97399383
3-tert-butyl-5-methyl-5-azaspiro[3.4]octane
CID 171594521
5-methyl-8-oxa-5-azaspiro[3.5]nonane
CID 130359992
1,2-dimethylcyclohexan-1-amine;4-methylmorpholine
CID 67592701
(4R)-1-iodo-5-methyl-1-azaspiro[3.4]octane
CID 145095406
(5R,8S)-1,8-dimethyl-1-azaspiro[4.4]nonane
CID 169125835
2-ethyl-4-methyl-4-azaspiro[2.4]heptane
CID 170608131

Frequently Asked Questions

What is the IUPAC name of 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane?
The IUPAC name of 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane (CID 122598907) is 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane.
What is the SMILES notation for 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane?
The canonical SMILES for 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane is CC1CCOCC12CCCCN2C.
What is the InChIKey of 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane?
The InChIKey is TVPCAWZGPFOUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10-5-8-13-9-11(10)6-3-4-7-12(11)2/h10H,3-9H2,1-2H3.
What are the key properties of 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane?
1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane has a molecular weight of 183.29 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,11-dimethyl-8-oxa-1-azaspiro[5.5]undecane is sourced from PubChem (CID 122598907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).