N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide

C17H18ClNO4S — CID 1242568

IUPACN-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(N(C(=O)C(C)C)S(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H18ClNO4S/c1-12(2)17(20)19(14-6-8-15(23-3)9-7-14)24(21,22)16-10-4-13(18)5-11-16/h4-12H,1-3H3
InChIKeyMMFJFIFSEIPBKQ-UHFFFAOYSA-N
MW367.85 g/mol
LogP3.73
Rot. Bonds5

About N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide

N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 1242568) has the molecular formula C17H18ClNO4S and a molecular weight of 367.85 g/mol. Its IUPAC name is N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID1242568
Molecular FormulaC17H18ClNO4S
Molecular Weight367.85 g/mol
Exact Mass367.06
IUPAC NameN-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(N(C(=O)C(C)C)S(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H18ClNO4S/c1-12(2)17(20)19(14-6-8-15(23-3)9-7-14)24(21,22)16-10-4-13(18)5-11-16/h4-12H,1-3H3
InChIKeyMMFJFIFSEIPBKQ-UHFFFAOYSA-N
XLogP3.73
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.85
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chlorophenyl)sulfonyl-3-methoxy-N-(4-methoxyphenyl)benzamide
CID 19211456
N-(4-chlorophenyl)sulfonyl-2-(4-ethoxyphenoxy)-N-(4-methoxyphenyl)acetamide
CID 19219172
(E)-N-(4-chlorophenyl)sulfonyl-2-cyano-N,3-bis(4-methoxyphenyl)prop-2-enamide
CID 19212449
N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-4-nitrobenzamide
CID 2907624
propan-2-yl 2-(N-(4-chlorophenyl)sulfonyl-4-methoxyanilino)acetate
CID 50891344
N'-(4-chlorophenyl)-N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonylethanimidamide
CID 14640908
2-(4-chloro-3,5-dimethylphenoxy)-N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 19217451
N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methyl-3-nitrobenzamide
CID 19219283
2-(2-bromo-4-chlorophenoxy)-N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 19220025
2-(4-bromo-3-methylphenoxy)-N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 19217990
2-(1,3-dioxoisoindol-2-yl)-N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonylpropanamide
CID 19219066
2-(2-tert-butylphenoxy)-N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 19217758

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide (CID 1242568) is N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(N(C(=O)C(C)C)S(=O)(=O)c2ccc(Cl)cc2)cc1.
What is the InChIKey of N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is MMFJFIFSEIPBKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO4S/c1-12(2)17(20)19(14-6-8-15(23-3)9-7-14)24(21,22)16-10-4-13(18)5-11-16/h4-12H,1-3H3.
What are the key properties of N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide?
N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 367.85 g/mol, XLogP of 3.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 1242568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).