3,9-dimethyl-2,9-diazaspiro[5.5]undecane

C11H22N2 — CID 22975671

IUPAC3,9-dimethyl-2,9-diazaspiro[5.5]undecane
SMILESCC1CCC2(CCN(C)CC2)CN1
InChIInChI=1S/C11H22N2/c1-10-3-4-11(9-12-10)5-7-13(2)8-6-11/h10,12H,3-9H2,1-2H3
InChIKeyIQSUJIFFPBPOIO-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.47
Rot. Bonds

About 3,9-dimethyl-2,9-diazaspiro[5.5]undecane

3,9-dimethyl-2,9-diazaspiro[5.5]undecane (PubChem CID 22975671) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3,9-dimethyl-2,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3,9-dimethyl-2,9-diazaspiro[5.5]undecane
PubChem CID22975671
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3,9-dimethyl-2,9-diazaspiro[5.5]undecane
SMILESCC1CCC2(CCN(C)CC2)CN1
InChIInChI=1S/C11H22N2/c1-10-3-4-11(9-12-10)5-7-13(2)8-6-11/h10,12H,3-9H2,1-2H3
InChIKeyIQSUJIFFPBPOIO-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,9-dimethyl-2,9-diazaspiro[5.5]undecane?
The IUPAC name of 3,9-dimethyl-2,9-diazaspiro[5.5]undecane (CID 22975671) is 3,9-dimethyl-2,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 3,9-dimethyl-2,9-diazaspiro[5.5]undecane?
The canonical SMILES for 3,9-dimethyl-2,9-diazaspiro[5.5]undecane is CC1CCC2(CCN(C)CC2)CN1.
What is the InChIKey of 3,9-dimethyl-2,9-diazaspiro[5.5]undecane?
The InChIKey is IQSUJIFFPBPOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-10-3-4-11(9-12-10)5-7-13(2)8-6-11/h10,12H,3-9H2,1-2H3.
What are the key properties of 3,9-dimethyl-2,9-diazaspiro[5.5]undecane?
3,9-dimethyl-2,9-diazaspiro[5.5]undecane has a molecular weight of 182.31 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-dimethyl-2,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 22975671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).