11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane

C16H32N2O — CID 64950231

IUPAC11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane
SMILESCCCC(COC)N1CCCNC2(CCCCC2)C1
InChIInChI=1S/C16H32N2O/c1-3-8-15(13-19-2)18-12-7-11-17-16(14-18)9-5-4-6-10-16/h15,17H,3-14H2,1-2H3
InChIKeyFGXMSTZZWLXXMX-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.80
Rot. Bonds5

About 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane

11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane (PubChem CID 64950231) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane
PubChem CID64950231
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane
SMILESCCCC(COC)N1CCCNC2(CCCCC2)C1
InChIInChI=1S/C16H32N2O/c1-3-8-15(13-19-2)18-12-7-11-17-16(14-18)9-5-4-6-10-16/h15,17H,3-14H2,1-2H3
InChIKeyFGXMSTZZWLXXMX-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane 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 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane (CID 64950231) is 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane is CCCC(COC)N1CCCNC2(CCCCC2)C1.
What is the InChIKey of 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane?
The InChIKey is FGXMSTZZWLXXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-8-15(13-19-2)18-12-7-11-17-16(14-18)9-5-4-6-10-16/h15,17H,3-14H2,1-2H3.
What are the key properties of 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane?
11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane has a molecular weight of 268.44 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(1-methoxypentan-2-yl)-7,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 64950231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).