1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide

C22H18Cl2N2O3S — CID 35556578

IUPAC1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)C1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C22H18Cl2N2O3S/c23-16-6-3-5-15(13-16)22(11-12-22)21(27)25-17-7-4-8-18(14-17)30(28,29)26-20-10-2-1-9-19(20)24/h1-10,13-14,26H,11-12H2,(H,25,27)
InChIKeyMWZXZRJXLSAEIY-UHFFFAOYSA-N
MW461.37 g/mol
LogP5.46
Rot. Bonds6

About 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide

1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide (PubChem CID 35556578) has the molecular formula C22H18Cl2N2O3S and a molecular weight of 461.37 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide
PubChem CID35556578
Molecular FormulaC22H18Cl2N2O3S
Molecular Weight461.37 g/mol
Exact Mass460.04
IUPAC Name1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)C1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C22H18Cl2N2O3S/c23-16-6-3-5-15(13-16)22(11-12-22)21(27)25-17-7-4-8-18(14-17)30(28,29)26-20-10-2-1-9-19(20)24/h1-10,13-14,26H,11-12H2,(H,25,27)
InChIKeyMWZXZRJXLSAEIY-UHFFFAOYSA-N
XLogP5.46
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.37
LogP ≤ 55.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]benzamide
CID 26593136
N-(3-acetamidophenyl)-1-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 110439128
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-methylbutanamide
CID 9415219
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclohexylacetamide
CID 29373732
1-(3-chlorophenyl)-N-(3-fluorophenyl)cyclobutane-1-carboxamide
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N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide
CID 26593129
2-chloro-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-6-fluorobenzamide
CID 36717455
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 55617002
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 26593186
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 5101960
1-(3-chlorophenyl)-N-pyridin-4-ylcyclohexane-1-carboxamide
CID 60542537
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 9068938

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide (CID 35556578) is 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide is O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)C1(c2cccc(Cl)c2)CC1.
What is the InChIKey of 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide?
The InChIKey is MWZXZRJXLSAEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18Cl2N2O3S/c23-16-6-3-5-15(13-16)22(11-12-22)21(27)25-17-7-4-8-18(14-17)30(28,29)26-20-10-2-1-9-19(20)24/h1-10,13-14,26H,11-12H2,(H,25,27).
What are the key properties of 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide?
1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide has a molecular weight of 461.37 g/mol, XLogP of 5.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 35556578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).