N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide

C14H17F3N2O4S — CID 50944502

IUPACN-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)N(CC(=O)N1CCOCC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H17F3N2O4S/c1-24(21,22)19(10-13(20)18-6-8-23-9-7-18)12-4-2-11(3-5-12)14(15,16)17/h2-5H,6-10H2,1H3
InChIKeyLAYMBTMBPMIKGR-UHFFFAOYSA-N
MW366.36 g/mol
LogP1.33
Rot. Bonds4

About N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide

N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide (PubChem CID 50944502) has the molecular formula C14H17F3N2O4S and a molecular weight of 366.36 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
PubChem CID50944502
Molecular FormulaC14H17F3N2O4S
Molecular Weight366.36 g/mol
Exact Mass366.09
IUPAC NameN-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)N(CC(=O)N1CCOCC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H17F3N2O4S/c1-24(21,22)19(10-13(20)18-6-8-23-9-7-18)12-4-2-11(3-5-12)14(15,16)17/h2-5H,6-10H2,1H3
InChIKeyLAYMBTMBPMIKGR-UHFFFAOYSA-N
XLogP1.33
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.36
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-oxo-2-piperidin-1-ylethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 50946136
N-(4-morpholin-4-ylsulfonylphenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide
CID 30256622
N-(2,6-dichlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 113156941
N-(2-morpholin-4-yl-2-oxoethyl)-N-(4-pyrazol-1-ylphenyl)methanesulfonamide
CID 162634500
N-(4-morpholin-4-ylsulfonylphenyl)-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
CID 30256714
N-(4-tert-butylphenyl)-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
CID 113154627
N-(4-morpholin-4-yl-4-oxobutyl)-N-[3-(trifluoromethyl)phenyl]methanesulfonamide
CID 53286809
N-(4-chlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)methanesulfonamide
CID 113143872
N-(2-chlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 765932
N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 165427573
N-(1-methylpyrazol-3-yl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 162634930
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
CID 113156552

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide?
The IUPAC name of N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide (CID 50944502) is N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide is CS(=O)(=O)N(CC(=O)N1CCOCC1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide?
The InChIKey is LAYMBTMBPMIKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O4S/c1-24(21,22)19(10-13(20)18-6-8-23-9-7-18)12-4-2-11(3-5-12)14(15,16)17/h2-5H,6-10H2,1H3.
What are the key properties of N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide?
N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide has a molecular weight of 366.36 g/mol, XLogP of 1.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide is sourced from PubChem (CID 50944502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).