9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane

C14H26N2O2 — CID 64935156

IUPAC9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane
SMILESCC1CNC2(CCCC2)CN1CC1COCCO1
InChIInChI=1S/C14H26N2O2/c1-12-8-15-14(4-2-3-5-14)11-16(12)9-13-10-17-6-7-18-13/h12-13,15H,2-11H2,1H3
InChIKeyZLNWGOGGSSNOBX-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.01
Rot. Bonds2

About 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane

9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane (PubChem CID 64935156) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane
PubChem CID64935156
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane
SMILESCC1CNC2(CCCC2)CN1CC1COCCO1
InChIInChI=1S/C14H26N2O2/c1-12-8-15-14(4-2-3-5-14)11-16(12)9-13-10-17-6-7-18-13/h12-13,15H,2-11H2,1H3
InChIKeyZLNWGOGGSSNOBX-UHFFFAOYSA-N
XLogP1.01
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane 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 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane (CID 64935156) is 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane is CC1CNC2(CCCC2)CN1CC1COCCO1.
What is the InChIKey of 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane?
The InChIKey is ZLNWGOGGSSNOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-12-8-15-14(4-2-3-5-14)11-16(12)9-13-10-17-6-7-18-13/h12-13,15H,2-11H2,1H3.
What are the key properties of 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane?
9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane has a molecular weight of 254.37 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1,4-dioxan-2-ylmethyl)-8-methyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64935156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).