4-methyl-2-azaspiro[5.5]undec-3-ene

C11H19N — CID 144676484

IUPAC4-methyl-2-azaspiro[5.5]undec-3-ene
SMILESCC1=CNCC2(CCCCC2)C1
InChIInChI=1S/C11H19N/c1-10-7-11(9-12-8-10)5-3-2-4-6-11/h8,12H,2-7,9H2,1H3
InChIKeyXNKBKOZSFPKVAZ-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.83
Rot. Bonds

About 4-methyl-2-azaspiro[5.5]undec-3-ene

4-methyl-2-azaspiro[5.5]undec-3-ene (PubChem CID 144676484) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 4-methyl-2-azaspiro[5.5]undec-3-ene.

Molecular Properties

Compound Name4-methyl-2-azaspiro[5.5]undec-3-ene
PubChem CID144676484
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name4-methyl-2-azaspiro[5.5]undec-3-ene
SMILESCC1=CNCC2(CCCCC2)C1
InChIInChI=1S/C11H19N/c1-10-7-11(9-12-8-10)5-3-2-4-6-11/h8,12H,2-7,9H2,1H3
InChIKeyXNKBKOZSFPKVAZ-UHFFFAOYSA-N
XLogP2.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-methyl-2-azaspiro[5.5]undec-3-ene 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 4-methyl-2-azaspiro[5.5]undec-3-ene?
The IUPAC name of 4-methyl-2-azaspiro[5.5]undec-3-ene (CID 144676484) is 4-methyl-2-azaspiro[5.5]undec-3-ene.
What is the SMILES notation for 4-methyl-2-azaspiro[5.5]undec-3-ene?
The canonical SMILES for 4-methyl-2-azaspiro[5.5]undec-3-ene is CC1=CNCC2(CCCCC2)C1.
What is the InChIKey of 4-methyl-2-azaspiro[5.5]undec-3-ene?
The InChIKey is XNKBKOZSFPKVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-10-7-11(9-12-8-10)5-3-2-4-6-11/h8,12H,2-7,9H2,1H3.
What are the key properties of 4-methyl-2-azaspiro[5.5]undec-3-ene?
4-methyl-2-azaspiro[5.5]undec-3-ene has a molecular weight of 165.28 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-azaspiro[5.5]undec-3-ene is sourced from PubChem (CID 144676484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).