N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide

C19H21N3O4S — CID 4824183

IUPACN-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NC2CC2)c1
InChIInChI=1S/C19H21N3O4S/c1-22(2)27(25,26)15-7-5-6-13(12-15)18(23)21-17-9-4-3-8-16(17)19(24)20-14-10-11-14/h3-9,12,14H,10-11H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyGZDWWOHPYHEXSI-UHFFFAOYSA-N
MW387.46 g/mol
LogP2.08
Rot. Bonds6

About N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide

N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide (PubChem CID 4824183) has the molecular formula C19H21N3O4S and a molecular weight of 387.46 g/mol. Its IUPAC name is N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
PubChem CID4824183
Molecular FormulaC19H21N3O4S
Molecular Weight387.46 g/mol
Exact Mass387.13
IUPAC NameN-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NC2CC2)c1
InChIInChI=1S/C19H21N3O4S/c1-22(2)27(25,26)15-7-5-6-13(12-15)18(23)21-17-9-4-3-8-16(17)19(24)20-14-10-11-14/h3-9,12,14H,10-11H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyGZDWWOHPYHEXSI-UHFFFAOYSA-N
XLogP2.08
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 126507636
2-(benzylamino)-N-butyl-4-chloro-5-sulfamoylbenzamide
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CID 126508113
N-Phenyl-3-(1-piperidinylsulfonyl)benzamide
CID 558837
N-(4-cyanophenyl)-3-(diethylsulfamoyl)benzamide
CID 3241048
2-[methyl(methylsulfonyl)amino]-N-[4-(1-piperidinylsulfonyl)phenyl]benzamide
CID 1228113
N-butyl-4-[(phenylsulfonyl)amino]benzamide
CID 2224401
N-Benzyl-2-(toluene-4-sulfonylamino)-benzamide
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CID 121398822

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide (CID 4824183) is N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The InChIKey is GZDWWOHPYHEXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4S/c1-22(2)27(25,26)15-7-5-6-13(12-15)18(23)21-17-9-4-3-8-16(17)19(24)20-14-10-11-14/h3-9,12,14H,10-11H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide has a molecular weight of 387.46 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide is sourced from PubChem (CID 4824183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).