N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide

C15H15Cl2NO3S — CID 166187697

IUPACN-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)N(C)Cc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2NO3S/c1-18(10-11-7-12(16)9-13(17)8-11)22(19,20)15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3
InChIKeyWMMATWPXDPMBSI-UHFFFAOYSA-N
MW360.26 g/mol
LogP3.82
Rot. Bonds5

About N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide

N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide (PubChem CID 166187697) has the molecular formula C15H15Cl2NO3S and a molecular weight of 360.26 g/mol. Its IUPAC name is N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide
PubChem CID166187697
Molecular FormulaC15H15Cl2NO3S
Molecular Weight360.26 g/mol
Exact Mass359.01
IUPAC NameN-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)N(C)Cc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2NO3S/c1-18(10-11-7-12(16)9-13(17)8-11)22(19,20)15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3
InChIKeyWMMATWPXDPMBSI-UHFFFAOYSA-N
XLogP3.82
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.26
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[(3,5-dichlorophenyl)methyl]-N-methylpyridine-3-sulfonamide
CID 61047622
N-[[4-(difluoromethoxy)phenyl]methyl]-2-methoxy-N-methylbenzenesulfonamide
CID 51169219
4-[[(2-methoxyphenyl)sulfonyl-methylamino]methyl]-N-methylbenzamide
CID 51249500
4-amino-N-benzyl-2-methoxy-N-methylbenzenesulfonamide
CID 43258003
N-(3-amino-2,2-dimethylpropyl)-2-methoxy-N-methylbenzenesulfonamide
CID 79652521
3-[benzyl(methyl)sulfamoyl]-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methylbenzamide
CID 31986975
3,5-dichloro-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylbenzenesulfonamide
CID 39794842
2-chloro-N-[(2-methoxyphenyl)methyl]-N-methylpyridine-3-sulfonamide
CID 61052630
N,N-dibenzyl-5-chloro-2-methoxybenzenesulfonamide
CID 1339272
2,5-dichloro-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylbenzenesulfonamide
CID 4789845
N-[(4-fluorophenyl)methyl]-2-methoxy-N,5-dimethylbenzenesulfonamide
CID 8797935
2-methoxy-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 8796550

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide?
The IUPAC name of N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide (CID 166187697) is N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide.
What is the SMILES notation for N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide?
The canonical SMILES for N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide is COc1ccccc1S(=O)(=O)N(C)Cc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide?
The InChIKey is WMMATWPXDPMBSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO3S/c1-18(10-11-7-12(16)9-13(17)8-11)22(19,20)15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3.
What are the key properties of N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide?
N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide has a molecular weight of 360.26 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dichlorophenyl)methyl]-2-methoxy-N-methylbenzenesulfonamide is sourced from PubChem (CID 166187697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).