2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine

C7H14F3N3O3S — CID 103548956

IUPAC2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine
SMILESO=S(=O)(NCC1COCCN1)NCC(F)(F)F
InChIInChI=1S/C7H14F3N3O3S/c8-7(9,10)5-13-17(14,15)12-3-6-4-16-2-1-11-6/h6,11-13H,1-5H2
InChIKeyKAKUEGLBXQADAL-UHFFFAOYSA-N
MW277.27 g/mol
LogP-1.04
Rot. Bonds5

About 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine

2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine (PubChem CID 103548956) has the molecular formula C7H14F3N3O3S and a molecular weight of 277.27 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine
PubChem CID103548956
Molecular FormulaC7H14F3N3O3S
Molecular Weight277.27 g/mol
Exact Mass277.07
IUPAC Name2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine
SMILESO=S(=O)(NCC1COCCN1)NCC(F)(F)F
InChIInChI=1S/C7H14F3N3O3S/c8-7(9,10)5-13-17(14,15)12-3-6-4-16-2-1-11-6/h6,11-13H,1-5H2
InChIKeyKAKUEGLBXQADAL-UHFFFAOYSA-N
XLogP-1.04
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2,2,2-trifluoroethoxy)ethyl]piperazine-1-sulfonamide
CID 63829021
2,2,2-trifluoro-N-(morpholin-3-ylmethyl)ethanamine
CID 65547504
3,3,3-trifluoro-N-(morpholin-3-ylmethyl)propan-1-amine
CID 65547513
[4-[2-(Trifluoromethoxy)ethyl]morpholin-3-yl]methanamine
CID 83096053
[4-(2,2-Difluoroethyl)morpholin-3-yl]methanamine
CID 83096643
[4-(2,2,2-Trifluoroethyl)morpholin-3-yl]methanamine
CID 83096646
1,1-difluoro-N-(morpholin-3-ylmethyl)methanesulfonamide
CID 103548837
N-(2-aminoethyl)-N-(2,2-difluoroethyl)morpholine-4-sulfonamide
CID 107493822
N-(2-aminoethyl)-N-(2,2,2-trifluoroethyl)morpholine-4-sulfonamide
CID 113966290
N-[2-(2,2-difluoroethoxy)ethyl]piperazine-1-sulfonamide
CID 114128349
3-(aminomethyl)-N-(2,2,2-trifluoroethyl)morpholine-4-sulfonamide
CID 114813019
2,2-difluoro-N-(morpholin-3-ylmethyl)ethanamine
CID 115407349

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine (CID 103548956) is 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine is O=S(=O)(NCC1COCCN1)NCC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine?
The InChIKey is KAKUEGLBXQADAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3N3O3S/c8-7(9,10)5-13-17(14,15)12-3-6-4-16-2-1-11-6/h6,11-13H,1-5H2.
What are the key properties of 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine?
2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine has a molecular weight of 277.27 g/mol, XLogP of -1.04, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(morpholin-3-ylmethylsulfamoyl)ethanamine is sourced from PubChem (CID 103548956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).