4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide

C19H22N2O4S — CID 110406127

IUPAC4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(C(C)C)C(=O)N3)cc1C
InChIInChI=1S/C19H22N2O4S/c1-11(2)18-15-10-13(5-7-16(15)20-19(18)22)21-26(23,24)14-6-8-17(25-4)12(3)9-14/h5-11,18,21H,1-4H3,(H,20,22)
InChIKeyOJPVBIHCPVCABD-UHFFFAOYSA-N
MW374.46 g/mol
LogP3.50
Rot. Bonds5

About 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide

4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide (PubChem CID 110406127) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide
PubChem CID110406127
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Name4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(C(C)C)C(=O)N3)cc1C
InChIInChI=1S/C19H22N2O4S/c1-11(2)18-15-10-13(5-7-16(15)20-19(18)22)21-26(23,24)14-6-8-17(25-4)12(3)9-14/h5-11,18,21H,1-4H3,(H,20,22)
InChIKeyOJPVBIHCPVCABD-UHFFFAOYSA-N
XLogP3.50
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-methoxy-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 110406161
2-oxo-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)-3H-1,3-benzoxazole-6-sulfonamide
CID 110406150
3-chloro-4-methoxy-N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 110405985
4-methoxy-3-methyl-N-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 126126840
4-methoxy-N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 110405960
N-(3-amino-4-methylphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 39439923
4-methoxy-3-methyl-N-(3-methylphenyl)benzenesulfonamide
CID 39824147
4-methoxy-3-methyl-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
CID 39824469
N-[4-fluoro-3-(trifluoromethyl)phenyl]-4-methoxy-3-methylbenzenesulfonamide
CID 28560482
2,5-dimethoxy-N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 110405976
N-(4-methoxy-3-methylphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 110776444
N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 40889291

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide (CID 110406127) is 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(C(C)C)C(=O)N3)cc1C.
What is the InChIKey of 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide?
The InChIKey is OJPVBIHCPVCABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-11(2)18-15-10-13(5-7-16(15)20-19(18)22)21-26(23,24)14-6-8-17(25-4)12(3)9-14/h5-11,18,21H,1-4H3,(H,20,22).
What are the key properties of 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide?
4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide has a molecular weight of 374.46 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-methyl-N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)benzenesulfonamide is sourced from PubChem (CID 110406127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).