N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide

C15H15ClN2O4S — CID 55348812

IUPACN-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(C)cc1Cl
InChIInChI=1S/C15H15ClN2O4S/c1-9-3-5-13(12(16)7-9)18-15(19)11-8-10(23(17,20)21)4-6-14(11)22-2/h3-8H,1-2H3,(H,18,19)(H2,17,20,21)
InChIKeyDTMPSYXRERZJHL-UHFFFAOYSA-N
MW354.82 g/mol
LogP2.56
Rot. Bonds4

About N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide

N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide (PubChem CID 55348812) has the molecular formula C15H15ClN2O4S and a molecular weight of 354.82 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
PubChem CID55348812
Molecular FormulaC15H15ClN2O4S
Molecular Weight354.82 g/mol
Exact Mass354.04
IUPAC NameN-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(C)cc1Cl
InChIInChI=1S/C15H15ClN2O4S/c1-9-3-5-13(12(16)7-9)18-15(19)11-8-10(23(17,20)21)4-6-14(11)22-2/h3-8H,1-2H3,(H,18,19)(H2,17,20,21)
InChIKeyDTMPSYXRERZJHL-UHFFFAOYSA-N
XLogP2.56
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(2-chloro-4-methylphenyl)-2-methoxybenzamide
CID 61093558
N-(2-fluoro-5-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 35606335
N-(3-chloro-4-methoxyphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7479079
N-(4-bromo-2-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 34054741
N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide
CID 4793034
N-(4-bromophenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7964867
N-(2,3-dimethyl-5-sulfamoylphenyl)-2,5-dimethoxybenzamide
CID 9141653
2-methoxy-N-[4-(3-methylphenoxy)phenyl]-5-sulfamoylbenzamide
CID 9453672
N-ethyl-2-methoxy-5-sulfamoylbenzamide
CID 6473438
2-methoxy-N-(3-methoxyphenyl)-5-sulfamoylbenzamide
CID 27167646
ethyl 4-[(2-methoxy-5-sulfamoylbenzoyl)amino]benzoate
CID 4851180
2,5-dichloro-N-(2-methyl-4-sulfamoylphenyl)thiophene-3-carboxamide
CID 107965296

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide (CID 55348812) is N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide is COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(C)cc1Cl.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide?
The InChIKey is DTMPSYXRERZJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4S/c1-9-3-5-13(12(16)7-9)18-15(19)11-8-10(23(17,20)21)4-6-14(11)22-2/h3-8H,1-2H3,(H,18,19)(H2,17,20,21).
What are the key properties of N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide?
N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide has a molecular weight of 354.82 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide is sourced from PubChem (CID 55348812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).