2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide

C18H17ClN2O3S — CID 71835079

IUPAC2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1ccccc1NS(=O)(=O)C=Cc1ccc(Cl)cc1
InChIInChI=1S/C18H17ClN2O3S/c19-14-7-5-13(6-8-14)11-12-25(23,24)21-17-4-2-1-3-16(17)18(22)20-15-9-10-15/h1-8,11-12,15,21H,9-10H2,(H,20,22)
InChIKeyUUHGRKXTZAEXBG-UHFFFAOYSA-N
MW376.87 g/mol
LogP3.64
Rot. Bonds6

About 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide

2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide (PubChem CID 71835079) has the molecular formula C18H17ClN2O3S and a molecular weight of 376.87 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide
PubChem CID71835079
Molecular FormulaC18H17ClN2O3S
Molecular Weight376.87 g/mol
Exact Mass376.06
IUPAC Name2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1ccccc1NS(=O)(=O)C=Cc1ccc(Cl)cc1
InChIInChI=1S/C18H17ClN2O3S/c19-14-7-5-13(6-8-14)11-12-25(23,24)21-17-4-2-1-3-16(17)18(22)20-15-9-10-15/h1-8,11-12,15,21H,9-10H2,(H,20,22)
InChIKeyUUHGRKXTZAEXBG-UHFFFAOYSA-N
XLogP3.64
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.87
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(4-chlorophenyl)ethenylsulfonylamino]phenyl]pyrrolidine-1-carboxamide
CID 76866318
2-(ethylsulfonylamino)-N-piperidin-4-ylbenzamide
CID 119389714
2-[[(E)-3-(3-chlorophenyl)prop-2-enoyl]amino]-N-cyclopropylbenzamide
CID 8700153
2-(benzenesulfonamido)-N-cycloheptylbenzamide
CID 126412627
N'-[(4-chlorophenyl)methylideneamino]-N-[2-(cyclohexylcarbamoyl)phenyl]oxamide
CID 3571504
2-(4-chlorobenzoyl)-N-cyclopentylbenzamide
CID 11841269
3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzenesulfonamide
CID 71835094
2-(4-chlorobenzoyl)-N-cycloheptylbenzamide
CID 11841438
2-[(3-chloro-4-cyanophenyl)sulfonylamino]-N-cyclopropylbenzamide
CID 87026587
2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclopropylbenzamide
CID 26965393
2-[(2-chlorophenyl)methylsulfonylamino]-N-cyclohexylbenzamide
CID 17321697
2-[[(E)-2-(4-chlorophenyl)ethenyl]sulfonylamino]-2-cyclopropylpropanoic acid
CID 43361670

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide?
The IUPAC name of 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide (CID 71835079) is 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide is O=C(NC1CC1)c1ccccc1NS(=O)(=O)C=Cc1ccc(Cl)cc1.
What is the InChIKey of 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide?
The InChIKey is UUHGRKXTZAEXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O3S/c19-14-7-5-13(6-8-14)11-12-25(23,24)21-17-4-2-1-3-16(17)18(22)20-15-9-10-15/h1-8,11-12,15,21H,9-10H2,(H,20,22).
What are the key properties of 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide?
2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide has a molecular weight of 376.87 g/mol, XLogP of 3.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide is sourced from PubChem (CID 71835079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).