N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide

C17H19N3O3S — CID 60612946

IUPACN-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide
SMILESCNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCc1ccccn1
InChIInChI=1S/C17H19N3O3S/c1-18-24(22,23)15-6-7-16-13(12-15)9-11-20(16)17(21)8-5-14-4-2-3-10-19-14/h2-4,6-7,10,12,18H,5,8-9,11H2,1H3
InChIKeyJAQHOBSXQMWHJQ-UHFFFAOYSA-N
MW345.42 g/mol
LogP1.51
Rot. Bonds5

About N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide

N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide (PubChem CID 60612946) has the molecular formula C17H19N3O3S and a molecular weight of 345.42 g/mol. Its IUPAC name is N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide
PubChem CID60612946
Molecular FormulaC17H19N3O3S
Molecular Weight345.42 g/mol
Exact Mass345.11
IUPAC NameN-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide
SMILESCNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCc1ccccn1
InChIInChI=1S/C17H19N3O3S/c1-18-24(22,23)15-6-7-16-13(12-15)9-11-20(16)17(21)8-5-14-4-2-3-10-19-14/h2-4,6-7,10,12,18H,5,8-9,11H2,1H3
InChIKeyJAQHOBSXQMWHJQ-UHFFFAOYSA-N
XLogP1.51
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,3-dihydroindol-1-yl)-3-pyridin-2-ylpropan-1-one
CID 110389221
1-[3-(3-chlorophenyl)propanoyl]-N-methyl-2,3-dihydroindole-5-sulfonamide
CID 51130845
N-methyl-1-(4-methylpentanoyl)-2,3-dihydroindole-5-sulfonamide
CID 51098284
N,N-dimethyl-1-(3-phenylpropanoyl)-2,3-dihydroindole-5-sulfonamide
CID 26769525
1-[(2S)-2-aminopropanoyl]-N-methyl-2,3-dihydroindole-5-sulfonamide
CID 119305331
4-methyl-2-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonylamino]-N-pyridin-2-ylpentanamide
CID 126458274
1-[5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]propan-1-one
CID 3238399
methyl 4-[5-(tert-butylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoate
CID 3453924
4-[5-(cyclooctylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoic acid
CID 20864290
N-methyl-3-nitro-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]benzenesulfonamide
CID 55447351
N-(2-methylphenyl)-1-(4-morpholin-4-yl-4-oxobutanoyl)-2,3-dihydroindole-5-sulfonamide
CID 53025563
1-[4-(azepan-1-yl)-4-oxobutanoyl]-N-(2-phenylpropyl)-2,3-dihydroindole-5-sulfonamide
CID 53057581

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide (CID 60612946) is N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide is CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCc1ccccn1.
What is the InChIKey of N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide?
The InChIKey is JAQHOBSXQMWHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3S/c1-18-24(22,23)15-6-7-16-13(12-15)9-11-20(16)17(21)8-5-14-4-2-3-10-19-14/h2-4,6-7,10,12,18H,5,8-9,11H2,1H3.
What are the key properties of N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide?
N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide has a molecular weight of 345.42 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-pyridin-2-ylpropanoyl)-2,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 60612946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).