N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide

C16H15F3N2O4S — CID 60541692

IUPACN-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C16H15F3N2O4S/c17-16(18,19)25-14-7-3-11(4-8-14)9-15(22)21-13-5-1-12(2-6-13)10-26(20,23)24/h1-8H,9-10H2,(H,21,22)(H2,20,23,24)
InChIKeyPEGGDDYEZINWTA-UHFFFAOYSA-N
MW388.37 g/mol
LogP2.55
Rot. Bonds6

About N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide

N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide (PubChem CID 60541692) has the molecular formula C16H15F3N2O4S and a molecular weight of 388.37 g/mol. Its IUPAC name is N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
PubChem CID60541692
Molecular FormulaC16H15F3N2O4S
Molecular Weight388.37 g/mol
Exact Mass388.07
IUPAC NameN-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C16H15F3N2O4S/c17-16(18,19)25-14-7-3-11(4-8-14)9-15(22)21-13-5-1-12(2-6-13)10-26(20,23)24/h1-8H,9-10H2,(H,21,22)(H2,20,23,24)
InChIKeyPEGGDDYEZINWTA-UHFFFAOYSA-N
XLogP2.55
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.37
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55548784
N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 46484833
2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277
[4-[4-(trifluoromethoxy)phenoxy]phenyl]methanesulfonamide
CID 91020906
2-naphthalen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 18277342
2-methyl-3-[4-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]propanoic acid
CID 120540878
N'-[4-(trifluoromethoxy)phenyl]propanediamide
CID 140529911
2-(2,3,4,5,6-pentafluorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 5010640
3,3,3-trifluoro-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 174736453
N-(1H-pyrazol-4-yl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 60506630
2-thiophen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2808201
[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 4-ethylbenzoate
CID 7364756

Frequently Asked Questions

What is the IUPAC name of N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide (CID 60541692) is N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide is NS(=O)(=O)Cc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1.
What is the InChIKey of N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is PEGGDDYEZINWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O4S/c17-16(18,19)25-14-7-3-11(4-8-14)9-15(22)21-13-5-1-12(2-6-13)10-26(20,23)24/h1-8H,9-10H2,(H,21,22)(H2,20,23,24).
What are the key properties of N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide?
N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 388.37 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 60541692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).