1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone

C10H17F3N2O3 — CID 103209686

IUPAC1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone
SMILESCNCC1CN(C(=O)COCC(F)(F)F)CCO1
InChIInChI=1S/C10H17F3N2O3/c1-14-4-8-5-15(2-3-18-8)9(16)6-17-7-10(11,12)13/h8,14H,2-7H2,1H3
InChIKeySUAFXBUMAZJWDJ-UHFFFAOYSA-N
MW270.25 g/mol
LogP0.01
Rot. Bonds5

About 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone

1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone (PubChem CID 103209686) has the molecular formula C10H17F3N2O3 and a molecular weight of 270.25 g/mol. Its IUPAC name is 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone.

Molecular Properties

Compound Name1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone
PubChem CID103209686
Molecular FormulaC10H17F3N2O3
Molecular Weight270.25 g/mol
Exact Mass270.12
IUPAC Name1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone
SMILESCNCC1CN(C(=O)COCC(F)(F)F)CCO1
InChIInChI=1S/C10H17F3N2O3/c1-14-4-8-5-15(2-3-18-8)9(16)6-17-7-10(11,12)13/h8,14H,2-7H2,1H3
InChIKeySUAFXBUMAZJWDJ-UHFFFAOYSA-N
XLogP0.01
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone 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 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone?
The IUPAC name of 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone (CID 103209686) is 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone.
What is the SMILES notation for 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone?
The canonical SMILES for 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone is CNCC1CN(C(=O)COCC(F)(F)F)CCO1.
What is the InChIKey of 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone?
The InChIKey is SUAFXBUMAZJWDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O3/c1-14-4-8-5-15(2-3-18-8)9(16)6-17-7-10(11,12)13/h8,14H,2-7H2,1H3.
What are the key properties of 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone?
1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone has a molecular weight of 270.25 g/mol, XLogP of 0.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone is sourced from PubChem (CID 103209686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).