3-methyl-2-azaspiro[4.4]nonane

C9H17N — CID 11564485

IUPAC3-methyl-2-azaspiro[4.4]nonane
SMILESCC1CC2(CCCC2)CN1
InChIInChI=1S/C9H17N/c1-8-6-9(7-10-8)4-2-3-5-9/h8,10H,2-7H2,1H3
InChIKeyNPBBRURTAYRIQO-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.93
Rot. Bonds

About 3-methyl-2-azaspiro[4.4]nonane

3-methyl-2-azaspiro[4.4]nonane (PubChem CID 11564485) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 3-methyl-2-azaspiro[4.4]nonane.

Molecular Properties

Compound Name3-methyl-2-azaspiro[4.4]nonane
PubChem CID11564485
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name3-methyl-2-azaspiro[4.4]nonane
SMILESCC1CC2(CCCC2)CN1
InChIInChI=1S/C9H17N/c1-8-6-9(7-10-8)4-2-3-5-9/h8,10H,2-7H2,1H3
InChIKeyNPBBRURTAYRIQO-UHFFFAOYSA-N
XLogP1.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-methyl-2-azaspiro[4.4]nonane 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[4.4]nonane?
The IUPAC name of 3-methyl-2-azaspiro[4.4]nonane (CID 11564485) is 3-methyl-2-azaspiro[4.4]nonane.
What is the SMILES notation for 3-methyl-2-azaspiro[4.4]nonane?
The canonical SMILES for 3-methyl-2-azaspiro[4.4]nonane is CC1CC2(CCCC2)CN1.
What is the InChIKey of 3-methyl-2-azaspiro[4.4]nonane?
The InChIKey is NPBBRURTAYRIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-8-6-9(7-10-8)4-2-3-5-9/h8,10H,2-7H2,1H3.
What are the key properties of 3-methyl-2-azaspiro[4.4]nonane?
3-methyl-2-azaspiro[4.4]nonane has a molecular weight of 139.24 g/mol, XLogP of 1.93, 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[4.4]nonane is sourced from PubChem (CID 11564485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).