N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide

C17H17ClN2O3S — CID 34744641

IUPACN-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H17ClN2O3S/c1-11-5-8-15(24(22,23)20-13-6-7-13)10-16(11)17(21)19-14-4-2-3-12(18)9-14/h2-5,8-10,13,20H,6-7H2,1H3,(H,19,21)
InChIKeyYEEJXCADTNDXGX-UHFFFAOYSA-N
MW364.85 g/mol
LogP3.34
Rot. Bonds5

About N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide

N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide (PubChem CID 34744641) has the molecular formula C17H17ClN2O3S and a molecular weight of 364.85 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
PubChem CID34744641
Molecular FormulaC17H17ClN2O3S
Molecular Weight364.85 g/mol
Exact Mass364.06
IUPAC NameN-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H17ClN2O3S/c1-11-5-8-15(24(22,23)20-13-6-7-13)10-16(11)17(21)19-14-4-2-3-12(18)9-14/h2-5,8-10,13,20H,6-7H2,1H3,(H,19,21)
InChIKeyYEEJXCADTNDXGX-UHFFFAOYSA-N
XLogP3.34
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.85
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-chloroanilino)-2-oxoethyl] 5-(cyclopropylsulfamoyl)-2-methylbenzoate
CID 46679348
N-(3-chlorophenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 90075218
5-(cyclopropylsulfamoyl)-N-[3-(ethylaminomethyl)phenyl]-2-methylbenzamide;hydrochloride
CID 119438257
N-[4-(cyclopropanecarbonylamino)phenyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 24613986
N-(3-chlorophenyl)-2-methoxy-5-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
CID 146256158
5-(cyclopropylsulfamoyl)-N-(9H-fluoren-2-yl)-2-methylbenzamide
CID 34074950
N-[3-chloro-4-(2-methoxyethylcarbamoyl)phenyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 55993465
5-chloro-N-[3-(cyclopropylsulfamoyl)phenyl]-2-nitrobenzamide
CID 25498819
N-(3-amino-4-methoxyphenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 119419615
5-(cyclopentylsulfamoyl)-2-fluoro-N-(3-methylphenyl)benzamide
CID 5157745
2-chloro-N-(3-chlorophenyl)-5-(methylsulfamoyl)benzamide
CID 9412137
N-[3-[[[5-(cyclopropylsulfamoyl)-2-methylbenzoyl]amino]methyl]phenyl]pyridine-4-carboxamide
CID 55953105

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide?
The IUPAC name of N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide (CID 34744641) is N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide.
What is the SMILES notation for N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide?
The canonical SMILES for N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide is Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide?
The InChIKey is YEEJXCADTNDXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3S/c1-11-5-8-15(24(22,23)20-13-6-7-13)10-16(11)17(21)19-14-4-2-3-12(18)9-14/h2-5,8-10,13,20H,6-7H2,1H3,(H,19,21).
What are the key properties of N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide?
N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide has a molecular weight of 364.85 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide is sourced from PubChem (CID 34744641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).