4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide

C17H15F3N2O4S — CID 35203522

IUPAC4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide
SMILESO=C(Nc1ccccc1OC(F)(F)F)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H15F3N2O4S/c18-17(19,20)26-15-4-2-1-3-14(15)21-16(23)11-5-9-13(10-6-11)27(24,25)22-12-7-8-12/h1-6,9-10,12,22H,7-8H2,(H,21,23)
InChIKeyMACULKIQORRQOX-UHFFFAOYSA-N
MW400.38 g/mol
LogP3.28
Rot. Bonds6

About 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide

4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide (PubChem CID 35203522) has the molecular formula C17H15F3N2O4S and a molecular weight of 400.38 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide
PubChem CID35203522
Molecular FormulaC17H15F3N2O4S
Molecular Weight400.38 g/mol
Exact Mass400.07
IUPAC Name4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide
SMILESO=C(Nc1ccccc1OC(F)(F)F)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H15F3N2O4S/c18-17(19,20)26-15-4-2-1-3-14(15)21-16(23)11-5-9-13(10-6-11)27(24,25)22-12-7-8-12/h1-6,9-10,12,22H,7-8H2,(H,21,23)
InChIKeyMACULKIQORRQOX-UHFFFAOYSA-N
XLogP3.28
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.38
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-butoxyphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 55953705
4-(cyclopropylsulfamoyl)-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 32611210
4-(cyclopropylsulfamoyl)-N-(2-methylsulfanylphenyl)benzamide
CID 46533931
4-iodo-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 43034347
N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
CID 40819169
4-nitro-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 788210
4-(cyclopropylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 26701623
N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 16572142
4-[methyl-(4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 24525403
4-(cyclopropylsulfamoyl)-N-(2-morpholin-4-ylphenyl)benzamide
CID 55377324
N-cyclopropyl-4-[(E)-3-oxo-3-[2-(trifluoromethoxy)anilino]prop-1-enyl]benzamide
CID 35750831
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 46644366

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide (CID 35203522) is 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide is O=C(Nc1ccccc1OC(F)(F)F)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide?
The InChIKey is MACULKIQORRQOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N2O4S/c18-17(19,20)26-15-4-2-1-3-14(15)21-16(23)11-5-9-13(10-6-11)27(24,25)22-12-7-8-12/h1-6,9-10,12,22H,7-8H2,(H,21,23).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide?
4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide has a molecular weight of 400.38 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide is sourced from PubChem (CID 35203522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).