N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide

C18H20N2O4S — CID 7908217

IUPACN-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CC2)ccc1C
InChIInChI=1S/C18H20N2O4S/c1-12-7-8-13(18(21)19-14-9-10-14)11-17(12)25(22,23)20-15-5-3-4-6-16(15)24-2/h3-8,11,14,20H,9-10H2,1-2H3,(H,19,21)
InChIKeyYHGNQECLWXIGRG-UHFFFAOYSA-N
MW360.44 g/mol
LogP2.70
Rot. Bonds6

About N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide

N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide (PubChem CID 7908217) has the molecular formula C18H20N2O4S and a molecular weight of 360.44 g/mol. Its IUPAC name is N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
PubChem CID7908217
Molecular FormulaC18H20N2O4S
Molecular Weight360.44 g/mol
Exact Mass360.11
IUPAC NameN-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CC2)ccc1C
InChIInChI=1S/C18H20N2O4S/c1-12-7-8-13(18(21)19-14-9-10-14)11-17(12)25(22,23)20-15-5-3-4-6-16(15)24-2/h3-8,11,14,20H,9-10H2,1-2H3,(H,19,21)
InChIKeyYHGNQECLWXIGRG-UHFFFAOYSA-N
XLogP2.70
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 9164199
N-cyclopentyl-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 2223474
N-(1-adamantyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 3257461
N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 96517593
N-(2,3-dimethylphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2687808
1-cyclopropyl-3-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylphenyl]thiourea
CID 7942694
3-[[3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid
CID 1081903
N-cyclopropyl-3-[[2-(2-methoxyanilino)-2-oxoethyl]amino]-4-methylbenzamide
CID 55897484
5-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-N-(2-methoxyphenyl)-2-methylbenzenesulfonamide
CID 2336291
N-(5-chloro-2-hydroxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 56581281
N-[(2-chlorophenyl)methyl]-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2612888
3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-[3-oxo-3-(propylamino)propyl]benzamide
CID 55954729

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide (CID 7908217) is N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide is COc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CC2)ccc1C.
What is the InChIKey of N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide?
The InChIKey is YHGNQECLWXIGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4S/c1-12-7-8-13(18(21)19-14-9-10-14)11-17(12)25(22,23)20-15-5-3-4-6-16(15)24-2/h3-8,11,14,20H,9-10H2,1-2H3,(H,19,21).
What are the key properties of N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide?
N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide has a molecular weight of 360.44 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide is sourced from PubChem (CID 7908217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).