N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide

C19H22N2O4S — CID 43047280

IUPACN-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NCC3CC3)c2)cc1
InChIInChI=1S/C19H22N2O4S/c1-2-25-17-10-8-16(9-11-17)21-26(23,24)18-5-3-4-15(12-18)19(22)20-13-14-6-7-14/h3-5,8-12,14,21H,2,6-7,13H2,1H3,(H,20,22)
InChIKeyADJZZZUVSYPYAQ-UHFFFAOYSA-N
MW374.46 g/mol
LogP3.03
Rot. Bonds8

About N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide

N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide (PubChem CID 43047280) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
PubChem CID43047280
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NCC3CC3)c2)cc1
InChIInChI=1S/C19H22N2O4S/c1-2-25-17-10-8-16(9-11-17)21-26(23,24)18-5-3-4-15(12-18)19(22)20-13-14-6-7-14/h3-5,8-12,14,21H,2,6-7,13H2,1H3,(H,20,22)
InChIKeyADJZZZUVSYPYAQ-UHFFFAOYSA-N
XLogP3.03
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 9118857
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 47007180
3-[(4-ethoxyphenyl)sulfamoyl]benzoate
CID 7040417
N-(3-aminobutyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide;hydrochloride
CID 119498833
N-(2-anilino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 55958800
3-[(4-ethoxyphenyl)sulfamoyl]-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]benzamide
CID 55932643
N-(4-ethoxyphenyl)-3-[[(4-fluorobenzoyl)amino]carbamoyl]benzenesulfonamide
CID 22109353
3-[(4-ethoxyphenyl)sulfamoyl]-N-[3-(2-phenylethoxy)propyl]benzamide
CID 55944966
3-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide
CID 9314938
3-(azocane-1-carbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide
CID 55370420
N-[2-(dimethylamino)-3-phenylpropyl]-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 24542716
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 24542679

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide (CID 43047280) is N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide is CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NCC3CC3)c2)cc1.
What is the InChIKey of N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The InChIKey is ADJZZZUVSYPYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-2-25-17-10-8-16(9-11-17)21-26(23,24)18-5-3-4-15(12-18)19(22)20-13-14-6-7-14/h3-5,8-12,14,21H,2,6-7,13H2,1H3,(H,20,22).
What are the key properties of N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide?
N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide has a molecular weight of 374.46 g/mol, XLogP of 3.03, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 43047280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).