4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide

C19H25NO4S — CID 100769242

IUPAC4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide
SMILESCC[C@H](NS(=O)(=O)c1ccc(OC)c(C)c1)c1ccc(OC)c(C)c1
InChIInChI=1S/C19H25NO4S/c1-6-17(15-7-9-18(23-4)13(2)11-15)20-25(21,22)16-8-10-19(24-5)14(3)12-16/h7-12,17,20H,6H2,1-5H3/t17-/m0/s1
InChIKeyRWUVTKGSAGHLQB-KRWDZBQOSA-N
MW363.48 g/mol
LogP3.75
Rot. Bonds7

About 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide

4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide (PubChem CID 100769242) has the molecular formula C19H25NO4S and a molecular weight of 363.48 g/mol. Its IUPAC name is 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide
PubChem CID100769242
Molecular FormulaC19H25NO4S
Molecular Weight363.48 g/mol
Exact Mass363.15
IUPAC Name4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide
SMILESCC[C@H](NS(=O)(=O)c1ccc(OC)c(C)c1)c1ccc(OC)c(C)c1
InChIInChI=1S/C19H25NO4S/c1-6-17(15-7-9-18(23-4)13(2)11-15)20-25(21,22)16-8-10-19(24-5)14(3)12-16/h7-12,17,20H,6H2,1-5H3/t17-/m0/s1
InChIKeyRWUVTKGSAGHLQB-KRWDZBQOSA-N
XLogP3.75
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.48
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide
CID 100769240
N-[1-(4-methoxy-3-methylphenyl)propyl]-4-methylbenzenesulfonamide
CID 133160247
4-methoxy-N-[1-(4-methoxyphenyl)propyl]-3-methylbenzenesulfonamide
CID 43904682
2-methoxy-5-[1-(4-methoxy-3-methylphenyl)propylsulfamoyl]-N-propan-2-ylbenzamide
CID 133158390
3-(2,5-dioxopyrrolidin-1-yl)-4-methoxy-N-[1-(4-methoxy-3-methylphenyl)propyl]benzenesulfonamide
CID 133162271
3,4-dimethoxy-N-[1-(4-propan-2-ylphenyl)propyl]benzenesulfonamide
CID 22772279
3-iodo-4-methoxy-N-[(1R)-1-(4-methylphenyl)propyl]benzenesulfonamide
CID 93486219
N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxy-2,3-dimethylbenzenesulfonamide
CID 133210573
N-[1-(3,4-dimethylphenyl)propyl]-4-methoxy-3-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 132665070
1-(4-chlorophenyl)-N-[1-(4-methoxy-3-methylphenyl)propyl]methanesulfonamide
CID 133210545
N-(2-ethylbutyl)-4-methoxy-3-methylbenzenesulfonamide
CID 115613367
4-methoxy-N-[1-(4-methoxyphenyl)propyl]-3,5-dimethylbenzenesulfonamide
CID 112823035

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide (CID 100769242) is 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide is CC[C@H](NS(=O)(=O)c1ccc(OC)c(C)c1)c1ccc(OC)c(C)c1.
What is the InChIKey of 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide?
The InChIKey is RWUVTKGSAGHLQB-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H25NO4S/c1-6-17(15-7-9-18(23-4)13(2)11-15)20-25(21,22)16-8-10-19(24-5)14(3)12-16/h7-12,17,20H,6H2,1-5H3/t17-/m0/s1.
What are the key properties of 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide?
4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide has a molecular weight of 363.48 g/mol, XLogP of 3.75, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]-3-methylbenzenesulfonamide is sourced from PubChem (CID 100769242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).