9-methyl-4-oxa-1-azaspiro[5.6]dodecane

C11H21NO — CID 130832557

IUPAC9-methyl-4-oxa-1-azaspiro[5.6]dodecane
SMILESCC1CCCC2(CC1)COCCN2
InChIInChI=1S/C11H21NO/c1-10-3-2-5-11(6-4-10)9-13-8-7-12-11/h10,12H,2-9H2,1H3
InChIKeyPPUYXWFEGAVMSI-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.95
Rot. Bonds

About 9-methyl-4-oxa-1-azaspiro[5.6]dodecane

9-methyl-4-oxa-1-azaspiro[5.6]dodecane (PubChem CID 130832557) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 9-methyl-4-oxa-1-azaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-methyl-4-oxa-1-azaspiro[5.6]dodecane
PubChem CID130832557
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name9-methyl-4-oxa-1-azaspiro[5.6]dodecane
SMILESCC1CCCC2(CC1)COCCN2
InChIInChI=1S/C11H21NO/c1-10-3-2-5-11(6-4-10)9-13-8-7-12-11/h10,12H,2-9H2,1H3
InChIKeyPPUYXWFEGAVMSI-UHFFFAOYSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-4-oxa-1-azaspiro[5.6]dodecane?
The IUPAC name of 9-methyl-4-oxa-1-azaspiro[5.6]dodecane (CID 130832557) is 9-methyl-4-oxa-1-azaspiro[5.6]dodecane.
What is the SMILES notation for 9-methyl-4-oxa-1-azaspiro[5.6]dodecane?
The canonical SMILES for 9-methyl-4-oxa-1-azaspiro[5.6]dodecane is CC1CCCC2(CC1)COCCN2.
What is the InChIKey of 9-methyl-4-oxa-1-azaspiro[5.6]dodecane?
The InChIKey is PPUYXWFEGAVMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10-3-2-5-11(6-4-10)9-13-8-7-12-11/h10,12H,2-9H2,1H3.
What are the key properties of 9-methyl-4-oxa-1-azaspiro[5.6]dodecane?
9-methyl-4-oxa-1-azaspiro[5.6]dodecane has a molecular weight of 183.29 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-4-oxa-1-azaspiro[5.6]dodecane is sourced from PubChem (CID 130832557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).