3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide

C18H20N2O5S — CID 18189816

IUPAC3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1
InChIInChI=1S/C18H20N2O5S/c1-24-14-8-9-17(25-2)16(11-14)19-18(21)12-4-3-5-15(10-12)26(22,23)20-13-6-7-13/h3-5,8-11,13,20H,6-7H2,1-2H3,(H,19,21)
InChIKeySKZHJXYIFXAWHM-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.40
Rot. Bonds7

About 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide

3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide (PubChem CID 18189816) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide
PubChem CID18189816
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC Name3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1
InChIInChI=1S/C18H20N2O5S/c1-24-14-8-9-17(25-2)16(11-14)19-18(21)12-4-3-5-15(10-12)26(22,23)20-13-6-7-13/h3-5,8-11,13,20H,6-7H2,1-2H3,(H,19,21)
InChIKeySKZHJXYIFXAWHM-UHFFFAOYSA-N
XLogP2.40
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-cyano-2-methoxyphenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 49182841
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-3-(dimethylamino)benzamide
CID 33159367
N-(2,5-dimethoxyphenyl)-3-(dimethylsulfamoyl)benzamide
CID 2083463
N-(2,5-dimethoxyphenyl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 95254693
N-(2,5-dimethoxyphenyl)-3-[(4-fluorophenyl)sulfamoyl]benzamide
CID 94788763
3-(azepan-1-ylsulfonyl)-N-(2,5-dimethoxyphenyl)benzamide
CID 9098514
3-N-cycloheptyl-1-N-(2,5-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109056122
3-(cyclopropylsulfamoyl)-N-(2,3-dimethylphenyl)benzamide
CID 30856229
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 55574013
3-(cyclopropylsulfamoyl)-N-[2-(4-methoxyphenoxy)ethyl]benzamide
CID 27174310
N-(2,5-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 46797680
N-(2,5-dimethoxyphenyl)-3-(hydrazinecarbonyl)benzenesulfonamide
CID 100657262

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide (CID 18189816) is 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide is COc1ccc(OC)c(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide?
The InChIKey is SKZHJXYIFXAWHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-24-14-8-9-17(25-2)16(11-14)19-18(21)12-4-3-5-15(10-12)26(22,23)20-13-6-7-13/h3-5,8-11,13,20H,6-7H2,1-2H3,(H,19,21).
What are the key properties of 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide?
3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide has a molecular weight of 376.43 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide is sourced from PubChem (CID 18189816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).