4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide

C19H22N2O3S — CID 109058401

IUPAC4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C19H22N2O3S/c1-3-14-6-4-5-13(2)18(14)20-19(22)15-7-11-17(12-8-15)25(23,24)21-16-9-10-16/h4-8,11-12,16,21H,3,9-10H2,1-2H3,(H,20,22)
InChIKeyXIMFVDRTUPQYMT-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.25
Rot. Bonds6

About 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide

4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide (PubChem CID 109058401) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
PubChem CID109058401
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C19H22N2O3S/c1-3-14-6-4-5-13(2)18(14)20-19(22)15-7-11-17(12-8-15)25(23,24)21-16-9-10-16/h4-8,11-12,16,21H,3,9-10H2,1-2H3,(H,20,22)
InChIKeyXIMFVDRTUPQYMT-UHFFFAOYSA-N
XLogP3.25
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 109058403
N-(2-ethyl-6-methylphenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 112770783
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-ethyl-6-methylphenyl)benzamide
CID 112770782
N-(2-ethyl-6-methylphenyl)-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 112770779
N-(2-ethyl-6-methylphenyl)-4-(3-methylbutylsulfamoyl)benzamide
CID 109061292
4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide
CID 27544592
4-tert-butyl-N-(2-ethyl-6-methylphenyl)benzamide
CID 1226062
N-(2-ethyl-6-methylphenyl)-4-sulfanylbenzamide
CID 107019746
N-cyclopropyl-4-[(2,6-dimethylphenyl)sulfamoyl]benzamide
CID 109058325
4-(tert-butylsulfamoyl)-N-(2,6-diethylphenyl)benzamide
CID 51310078
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
3-chloro-N-(2-ethyl-6-methylphenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 46762958

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide (CID 109058401) is 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide is CCc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide?
The InChIKey is XIMFVDRTUPQYMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-3-14-6-4-5-13(2)18(14)20-19(22)15-7-11-17(12-8-15)25(23,24)21-16-9-10-16/h4-8,11-12,16,21H,3,9-10H2,1-2H3,(H,20,22).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide?
4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide has a molecular weight of 358.46 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide is sourced from PubChem (CID 109058401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).