N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide

C19H22N2O4S — CID 42388579

IUPACN-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide
SMILESCCCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1
InChIInChI=1S/C19H22N2O4S/c1-3-12-25-17-5-7-18(8-6-17)26(23,24)20-16-4-9-19-15(13-16)10-11-21(19)14(2)22/h4-9,13,20H,3,10-12H2,1-2H3
InChIKeyPGJRZLHYKZLDAQ-UHFFFAOYSA-N
MW374.46 g/mol
LogP3.19
Rot. Bonds6

About N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide

N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide (PubChem CID 42388579) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide
PubChem CID42388579
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide
SMILESCCCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1
InChIInChI=1S/C19H22N2O4S/c1-3-12-25-17-5-7-18(8-6-17)26(23,24)20-16-4-9-19-15(13-16)10-11-21(19)14(2)22/h4-9,13,20H,3,10-12H2,1-2H3
InChIKeyPGJRZLHYKZLDAQ-UHFFFAOYSA-N
XLogP3.19
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)-4-propoxybenzenesulfonamide
CID 16927341
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-butoxybenzamide
CID 42423988
N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propoxybenzenesulfonamide
CID 16926598
N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-propoxybenzenesulfonamide
CID 16943958
1-acetyl-N-(4-butan-2-ylphenyl)-2,3-dihydroindole-5-sulfonamide
CID 24509967
N-[3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonylamino]phenyl]acetamide
CID 40687880
N-(1-acetyl-2,3-dihydroindol-5-yl)-3-(4-methoxyphenoxy)propanamide
CID 24637691
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,3,5,6-tetramethylbenzenesulfonamide
CID 42388555
5-[(4-methoxyphenyl)sulfamoyl]-N-propyl-2,3-dihydroindole-1-carboxamide
CID 53058967
methyl N-[4-[(1-acetyl-2,3-dihydroindol-6-yl)sulfamoyl]phenyl]carbamate
CID 91624470
N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 7498773
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-chlorobenzenesulfonamide
CID 42388549

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide (CID 42388579) is N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide is CCCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide?
The InChIKey is PGJRZLHYKZLDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-3-12-25-17-5-7-18(8-6-17)26(23,24)20-16-4-9-19-15(13-16)10-11-21(19)14(2)22/h4-9,13,20H,3,10-12H2,1-2H3.
What are the key properties of N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide?
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide has a molecular weight of 374.46 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-5-yl)-4-propoxybenzenesulfonamide is sourced from PubChem (CID 42388579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).