4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane

C19H38N4O2 — CID 143437515

IUPAC4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane
SMILESCN1CCCC2(C1)CN(C)CCO2.CN1CCCC2(CNCCO2)C1
InChIInChI=1S/C10H20N2O.C9H18N2O/c1-11-5-3-4-10(8-11)9-12(2)6-7-13-10;1-11-5-2-3-9(8-11)7-10-4-6-12-9/h3-9H2,1-2H3;10H,2-8H2,1H3
InChIKeyDPBTYNGHUPTZFI-UHFFFAOYSA-N
MW354.54 g/mol
LogP0.48
Rot. Bonds

About 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane

4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane (PubChem CID 143437515) has the molecular formula C19H38N4O2 and a molecular weight of 354.54 g/mol. Its IUPAC name is 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane
PubChem CID143437515
Molecular FormulaC19H38N4O2
Molecular Weight354.54 g/mol
Exact Mass354.30
IUPAC Name4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane
SMILESCN1CCCC2(C1)CN(C)CCO2.CN1CCCC2(CNCCO2)C1
InChIInChI=1S/C10H20N2O.C9H18N2O/c1-11-5-3-4-10(8-11)9-12(2)6-7-13-10;1-11-5-2-3-9(8-11)7-10-4-6-12-9/h3-9H2,1-2H3;10H,2-8H2,1H3
InChIKeyDPBTYNGHUPTZFI-UHFFFAOYSA-N
XLogP0.48
TPSA40.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.54
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane 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 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane?
The IUPAC name of 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane (CID 143437515) is 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane.
What is the SMILES notation for 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane?
The canonical SMILES for 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane is CN1CCCC2(C1)CN(C)CCO2.CN1CCCC2(CNCCO2)C1.
What is the InChIKey of 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane?
The InChIKey is DPBTYNGHUPTZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O.C9H18N2O/c1-11-5-3-4-10(8-11)9-12(2)6-7-13-10;1-11-5-2-3-9(8-11)7-10-4-6-12-9/h3-9H2,1-2H3;10H,2-8H2,1H3.
What are the key properties of 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane?
4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane has a molecular weight of 354.54 g/mol, XLogP of 0.48, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dimethyl-1-oxa-4,8-diazaspiro[5.5]undecane;8-methyl-1-oxa-4,8-diazaspiro[5.5]undecane is sourced from PubChem (CID 143437515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).