3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide

C18H19ClN2O3S — CID 109062317

IUPAC3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(S(=O)(=O)NCCc2cccc(Cl)c2)c1
InChIInChI=1S/C18H19ClN2O3S/c19-15-5-1-3-13(11-15)9-10-20-25(23,24)17-6-2-4-14(12-17)18(22)21-16-7-8-16/h1-6,11-12,16,20H,7-10H2,(H,21,22)
InChIKeyOZTDSYXIMWBMPL-UHFFFAOYSA-N
MW378.88 g/mol
LogP2.75
Rot. Bonds7

About 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide

3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide (PubChem CID 109062317) has the molecular formula C18H19ClN2O3S and a molecular weight of 378.88 g/mol. Its IUPAC name is 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide
PubChem CID109062317
Molecular FormulaC18H19ClN2O3S
Molecular Weight378.88 g/mol
Exact Mass378.08
IUPAC Name3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(S(=O)(=O)NCCc2cccc(Cl)c2)c1
InChIInChI=1S/C18H19ClN2O3S/c19-15-5-1-3-13(11-15)9-10-20-25(23,24)17-6-2-4-14(12-17)18(22)21-16-7-8-16/h1-6,11-12,16,20H,7-10H2,(H,21,22)
InChIKeyOZTDSYXIMWBMPL-UHFFFAOYSA-N
XLogP2.75
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.88
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-chlorophenyl)ethyl]-3-(cyclopropylmethylsulfamoyl)benzamide
CID 37002294
3-[2-[(3-chlorophenyl)sulfonylamino]ethyl]benzoic acid
CID 174539221
3-(benzylsulfamoyl)-N-cyclopropylbenzamide
CID 9165600
N-cyclopropyl-3-(pentylsulfamoyl)benzamide
CID 109062314
3-[(3-chlorophenyl)sulfamoyl]-N-cyclohexylbenzamide
CID 9043246
N-cyclopropyl-3-(methylsulfamoyl)benzamide
CID 35743549
4-[[(3-chlorophenyl)sulfonylamino]methyl]-N-cyclohexylbenzamide
CID 45273834
N-cyclopentyl-3-(2-thiophen-2-ylethylsulfamoyl)benzamide
CID 72938546
N-cyclopentyl-3-(2-pyridin-2-ylethylsulfamoyl)benzamide
CID 72859318
3-(hydrazinecarbonyl)-N-(2-phenylethyl)benzenesulfonamide
CID 100656698
2-[2-(3-chlorophenyl)ethylamino]-N-cyclopropylpyrimidine-5-carboxamide
CID 109247342
4-[[3-(2-methoxyethylsulfamoyl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119230330

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide?
The IUPAC name of 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide (CID 109062317) is 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide.
What is the SMILES notation for 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide?
The canonical SMILES for 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide is O=C(NC1CC1)c1cccc(S(=O)(=O)NCCc2cccc(Cl)c2)c1.
What is the InChIKey of 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide?
The InChIKey is OZTDSYXIMWBMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3S/c19-15-5-1-3-13(11-15)9-10-20-25(23,24)17-6-2-4-14(12-17)18(22)21-16-7-8-16/h1-6,11-12,16,20H,7-10H2,(H,21,22).
What are the key properties of 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide?
3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide has a molecular weight of 378.88 g/mol, XLogP of 2.75, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide is sourced from PubChem (CID 109062317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).