1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide

C14H14ClNO2S — CID 18891258

IUPAC1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C14H14ClNO2S/c1-11-3-2-4-14(9-11)16-19(17,18)10-12-5-7-13(15)8-6-12/h2-9,16H,10H2,1H3
InChIKeyUQTFHUSAXPKYRB-UHFFFAOYSA-N
MW295.79 g/mol
LogP3.59
Rot. Bonds4

About 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide

1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide (PubChem CID 18891258) has the molecular formula C14H14ClNO2S and a molecular weight of 295.79 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide
PubChem CID18891258
Molecular FormulaC14H14ClNO2S
Molecular Weight295.79 g/mol
Exact Mass295.04
IUPAC Name1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C14H14ClNO2S/c1-11-3-2-4-14(9-11)16-19(17,18)10-12-5-7-13(15)8-6-12/h2-9,16H,10H2,1H3
InChIKeyUQTFHUSAXPKYRB-UHFFFAOYSA-N
XLogP3.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.79
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanesulfonamide
CID 122285001
1-(3-methylphenyl)-N-(3-methylsulfonylphenyl)methanesulfonamide
CID 110779468
1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
CID 18891284
N-[(4-chlorophenyl)methyl]-3-methylaniline
CID 15533172
1-(4-chlorophenyl)-N-[3-(2,4-dimethoxy-5-propan-2-ylphenyl)phenyl]methanesulfonamide
CID 71012362
1-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)methanesulfonamide
CID 110778592
4-chloro-N-(3-methylphenyl)butane-1-sulfonamide
CID 116815142
1-(3-aminophenyl)-N-(4-chlorophenyl)methanesulfonamide
CID 43255960
3-iodo-N-(3-methylphenyl)propane-1-sulfonamide
CID 146534327
2-methyl-2-[3-[(3-methylphenyl)methylsulfonylamino]phenyl]propanoic acid
CID 167927121
1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
CID 18891286
1-(3,4-dichlorophenyl)-N-(4-methylphenyl)methanesulfonamide
CID 134052267

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide (CID 18891258) is 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide is Cc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1.
What is the InChIKey of 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide?
The InChIKey is UQTFHUSAXPKYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO2S/c1-11-3-2-4-14(9-11)16-19(17,18)10-12-5-7-13(15)8-6-12/h2-9,16H,10H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide?
1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide has a molecular weight of 295.79 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide is sourced from PubChem (CID 18891258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).