N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide

C17H18N2O3S — CID 17444395

IUPACN-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCc3ccccc32)cc1
InChIInChI=1S/C17H18N2O3S/c1-18-23(21,22)14-9-6-13(7-10-14)17(20)19-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16,18H,8,11H2,1H3,(H,19,20)
InChIKeyIMOILEPJRTZRFZ-UHFFFAOYSA-N
MW330.41 g/mol
LogP2.01
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide

N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide (PubChem CID 17444395) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide
PubChem CID17444395
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCc3ccccc32)cc1
InChIInChI=1S/C17H18N2O3S/c1-18-23(21,22)14-9-6-13(7-10-14)17(20)19-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16,18H,8,11H2,1H3,(H,19,20)
InChIKeyIMOILEPJRTZRFZ-UHFFFAOYSA-N
XLogP2.01
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide
CID 56782488
N-(2,3-dihydro-1H-inden-1-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 51297408
4-(phenylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42992525
4-[[(2R)-butan-2-yl]sulfamoyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 9216707
4-propan-2-ylsulfonyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 51955051
N-(8-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-4-(methylsulfamoyl)benzamide
CID 55462599
4-cyano-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 47126975
4-(diethylsulfamoyl)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2450747
N-[(4R)-3,4-dihydro-2H-thiochromen-4-yl]-3-(methylsulfamoyl)benzamide
CID 41176413
4-bromo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2450710
4-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzene-1,4-dicarboxamide
CID 42916066
4-acetamido-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 7688434

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide (CID 17444395) is N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1ccc(C(=O)NC2CCc3ccccc32)cc1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide?
The InChIKey is IMOILEPJRTZRFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-18-23(21,22)14-9-6-13(7-10-14)17(20)19-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16,18H,8,11H2,1H3,(H,19,20).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide?
N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide has a molecular weight of 330.41 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide is sourced from PubChem (CID 17444395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).