3-methyl-2-azaspiro[5.5]undecane

C11H21N — CID 11686967

IUPAC3-methyl-2-azaspiro[5.5]undecane
SMILESCC1CCC2(CCCCC2)CN1
InChIInChI=1S/C11H21N/c1-10-5-8-11(9-12-10)6-3-2-4-7-11/h10,12H,2-9H2,1H3
InChIKeySHUYYKLMALLRRI-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.71
Rot. Bonds

About 3-methyl-2-azaspiro[5.5]undecane

3-methyl-2-azaspiro[5.5]undecane (PubChem CID 11686967) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 3-methyl-2-azaspiro[5.5]undecane.

Molecular Properties

Compound Name3-methyl-2-azaspiro[5.5]undecane
PubChem CID11686967
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name3-methyl-2-azaspiro[5.5]undecane
SMILESCC1CCC2(CCCCC2)CN1
InChIInChI=1S/C11H21N/c1-10-5-8-11(9-12-10)6-3-2-4-7-11/h10,12H,2-9H2,1H3
InChIKeySHUYYKLMALLRRI-UHFFFAOYSA-N
XLogP2.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-methyl-2-azaspiro[5.5]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-azaspiro[5.5]undecane?
The IUPAC name of 3-methyl-2-azaspiro[5.5]undecane (CID 11686967) is 3-methyl-2-azaspiro[5.5]undecane.
What is the SMILES notation for 3-methyl-2-azaspiro[5.5]undecane?
The canonical SMILES for 3-methyl-2-azaspiro[5.5]undecane is CC1CCC2(CCCCC2)CN1.
What is the InChIKey of 3-methyl-2-azaspiro[5.5]undecane?
The InChIKey is SHUYYKLMALLRRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-10-5-8-11(9-12-10)6-3-2-4-7-11/h10,12H,2-9H2,1H3.
What are the key properties of 3-methyl-2-azaspiro[5.5]undecane?
3-methyl-2-azaspiro[5.5]undecane has a molecular weight of 167.30 g/mol, XLogP of 2.71, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-azaspiro[5.5]undecane is sourced from PubChem (CID 11686967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).