2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine

C13H26N2O2 — CID 59991558

IUPAC2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine
SMILES[3H]CC1CN(CCC2CN([3H])CC(C)O2)CC(C)O1
InChIInChI=1S/C13H26N2O2/c1-10-6-14-7-13(17-10)4-5-15-8-11(2)16-12(3)9-15/h10-14H,4-9H2,1-3H3/i2T/hT
InChIKeyWYAYLTQGAFHRFZ-VPHWMDMYSA-N
MW246.38 g/mol
LogP0.86
Rot. Bonds4

About 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine

2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine (PubChem CID 59991558) has the molecular formula C13H26N2O2 and a molecular weight of 246.38 g/mol. Its IUPAC name is 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine.

Molecular Properties

Compound Name2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine
PubChem CID59991558
Molecular FormulaC13H26N2O2
Molecular Weight246.38 g/mol
Exact Mass246.22
IUPAC Name2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine
SMILES[3H]CC1CN(CCC2CN([3H])CC(C)O2)CC(C)O1
InChIInChI=1S/C13H26N2O2/c1-10-6-14-7-13(17-10)4-5-15-8-11(2)16-12(3)9-15/h10-14H,4-9H2,1-3H3/i2T/hT
InChIKeyWYAYLTQGAFHRFZ-VPHWMDMYSA-N
XLogP0.86
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine 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-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine?
The IUPAC name of 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine (CID 59991558) is 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine.
What is the SMILES notation for 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine?
The canonical SMILES for 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine is [3H]CC1CN(CCC2CN([3H])CC(C)O2)CC(C)O1.
What is the InChIKey of 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine?
The InChIKey is WYAYLTQGAFHRFZ-VPHWMDMYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10-6-14-7-13(17-10)4-5-15-8-11(2)16-12(3)9-15/h10-14H,4-9H2,1-3H3/i2T/hT.
What are the key properties of 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine?
2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine has a molecular weight of 246.38 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[2-(6-methyl-4-tritiomorpholin-2-yl)ethyl]-6-(tritiomethyl)morpholine is sourced from PubChem (CID 59991558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).