3-(benzylsulfamoyl)-N-cyclopropylbenzamide

C17H18N2O3S — CID 9165600

IUPAC3-(benzylsulfamoyl)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H18N2O3S/c20-17(19-15-9-10-15)14-7-4-8-16(11-14)23(21,22)18-12-13-5-2-1-3-6-13/h1-8,11,15,18H,9-10,12H2,(H,19,20)
InChIKeyLXYSHBYJYMCESH-UHFFFAOYSA-N
MW330.41 g/mol
LogP2.06
Rot. Bonds6

About 3-(benzylsulfamoyl)-N-cyclopropylbenzamide

3-(benzylsulfamoyl)-N-cyclopropylbenzamide (PubChem CID 9165600) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is 3-(benzylsulfamoyl)-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-(benzylsulfamoyl)-N-cyclopropylbenzamide
PubChem CID9165600
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Name3-(benzylsulfamoyl)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H18N2O3S/c20-17(19-15-9-10-15)14-7-4-8-16(11-14)23(21,22)18-12-13-5-2-1-3-6-13/h1-8,11,15,18H,9-10,12H2,(H,19,20)
InChIKeyLXYSHBYJYMCESH-UHFFFAOYSA-N
XLogP2.06
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(benzylsulfamoyl)-N-[(1S,2R)-2-methylcyclohexyl]benzamide
CID 9404478
N-benzyl-3-(hydrazinecarbonyl)benzenesulfonamide
CID 2442245
3-(benzylsulfamoyl)-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide
CID 60604981
N-[2-(aminomethyl)cyclopentyl]-3-(benzylsulfamoyl)benzamide
CID 119602999
3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide
CID 109062317
N-(4-aminocyclohexyl)-3-benzylsulfonylbenzamide
CID 119476656
N-cyclopropyl-3-(pentylsulfamoyl)benzamide
CID 109062314
1-N-benzyl-3-N-cyclopropylbenzene-1,3-dicarboxamide
CID 109050687
N-cyclopropyl-3-(methylsulfamoyl)benzamide
CID 35743549
4-[[(3-chlorophenyl)sulfonylamino]methyl]-N-cyclohexylbenzamide
CID 45273834
4-[[3-(2-methoxyethylsulfamoyl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119230330
3-(pyridin-3-ylmethylsulfamoyl)-N-pyrrolidin-3-ylbenzamide
CID 77084633

Frequently Asked Questions

What is the IUPAC name of 3-(benzylsulfamoyl)-N-cyclopropylbenzamide?
The IUPAC name of 3-(benzylsulfamoyl)-N-cyclopropylbenzamide (CID 9165600) is 3-(benzylsulfamoyl)-N-cyclopropylbenzamide.
What is the SMILES notation for 3-(benzylsulfamoyl)-N-cyclopropylbenzamide?
The canonical SMILES for 3-(benzylsulfamoyl)-N-cyclopropylbenzamide is O=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1.
What is the InChIKey of 3-(benzylsulfamoyl)-N-cyclopropylbenzamide?
The InChIKey is LXYSHBYJYMCESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c20-17(19-15-9-10-15)14-7-4-8-16(11-14)23(21,22)18-12-13-5-2-1-3-6-13/h1-8,11,15,18H,9-10,12H2,(H,19,20).
What are the key properties of 3-(benzylsulfamoyl)-N-cyclopropylbenzamide?
3-(benzylsulfamoyl)-N-cyclopropylbenzamide has a molecular weight of 330.41 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzylsulfamoyl)-N-cyclopropylbenzamide is sourced from PubChem (CID 9165600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).