2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane

C11H20N2O — CID 118974102

IUPAC2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane
SMILESCN1CC2(CCN(C3COC3)CC2)C1
InChIInChI=1S/C11H20N2O/c1-12-8-11(9-12)2-4-13(5-3-11)10-6-14-7-10/h10H,2-9H2,1H3
InChIKeyYERVWDDJMNQBKY-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.41
Rot. Bonds1

About 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane

2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane (PubChem CID 118974102) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane
PubChem CID118974102
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane
SMILESCN1CC2(CCN(C3COC3)CC2)C1
InChIInChI=1S/C11H20N2O/c1-12-8-11(9-12)2-4-13(5-3-11)10-6-14-7-10/h10H,2-9H2,1H3
InChIKeyYERVWDDJMNQBKY-UHFFFAOYSA-N
XLogP0.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]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 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane (CID 118974102) is 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane is CN1CC2(CCN(C3COC3)CC2)C1.
What is the InChIKey of 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane?
The InChIKey is YERVWDDJMNQBKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-12-8-11(9-12)2-4-13(5-3-11)10-6-14-7-10/h10H,2-9H2,1H3.
What are the key properties of 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane?
2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane has a molecular weight of 196.29 g/mol, XLogP of 0.41, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-(oxetan-3-yl)-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 118974102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).