3,11-dimethyl-3-azaspiro[5.5]undecane

C12H23N — CID 118029302

IUPAC3,11-dimethyl-3-azaspiro[5.5]undecane
SMILESCC1CCCCC12CCN(C)CC2
InChIInChI=1S/C12H23N/c1-11-5-3-4-6-12(11)7-9-13(2)10-8-12/h11H,3-10H2,1-2H3
InChIKeyHEUGFRDRGHDKQT-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.91
Rot. Bonds

About 3,11-dimethyl-3-azaspiro[5.5]undecane

3,11-dimethyl-3-azaspiro[5.5]undecane (PubChem CID 118029302) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 3,11-dimethyl-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name3,11-dimethyl-3-azaspiro[5.5]undecane
PubChem CID118029302
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name3,11-dimethyl-3-azaspiro[5.5]undecane
SMILESCC1CCCCC12CCN(C)CC2
InChIInChI=1S/C12H23N/c1-11-5-3-4-6-12(11)7-9-13(2)10-8-12/h11H,3-10H2,1-2H3
InChIKeyHEUGFRDRGHDKQT-UHFFFAOYSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,11-dimethyl-3-azaspiro[5.5]undecane?
The IUPAC name of 3,11-dimethyl-3-azaspiro[5.5]undecane (CID 118029302) is 3,11-dimethyl-3-azaspiro[5.5]undecane.
What is the SMILES notation for 3,11-dimethyl-3-azaspiro[5.5]undecane?
The canonical SMILES for 3,11-dimethyl-3-azaspiro[5.5]undecane is CC1CCCCC12CCN(C)CC2.
What is the InChIKey of 3,11-dimethyl-3-azaspiro[5.5]undecane?
The InChIKey is HEUGFRDRGHDKQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11-5-3-4-6-12(11)7-9-13(2)10-8-12/h11H,3-10H2,1-2H3.
What are the key properties of 3,11-dimethyl-3-azaspiro[5.5]undecane?
3,11-dimethyl-3-azaspiro[5.5]undecane has a molecular weight of 181.32 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,11-dimethyl-3-azaspiro[5.5]undecane is sourced from PubChem (CID 118029302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).