3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide

C20H22N2O3S — CID 55533364

IUPAC3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
SMILESCN(C(=O)c1cccc(S(=O)(=O)NC2CC2)c1)C1CCc2ccccc21
InChIInChI=1S/C20H22N2O3S/c1-22(19-12-9-14-5-2-3-8-18(14)19)20(23)15-6-4-7-17(13-15)26(24,25)21-16-10-11-16/h2-8,13,16,19,21H,9-12H2,1H3
InChIKeyQFIMCDKOXJXUSB-UHFFFAOYSA-N
MW370.47 g/mol
LogP2.89
Rot. Bonds5

About 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide

3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide (PubChem CID 55533364) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
PubChem CID55533364
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
SMILESCN(C(=O)c1cccc(S(=O)(=O)NC2CC2)c1)C1CCc2ccccc21
InChIInChI=1S/C20H22N2O3S/c1-22(19-12-9-14-5-2-3-8-18(14)19)20(23)15-6-4-7-17(13-15)26(24,25)21-16-10-11-16/h2-8,13,16,19,21H,9-12H2,1H3
InChIKeyQFIMCDKOXJXUSB-UHFFFAOYSA-N
XLogP2.89
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-inden-1-yl)-3-(methanesulfonamido)-N-methylbenzamide
CID 134053339
3-(cyclopropylsulfamoyl)-N-methyl-N-phenylbenzamide
CID 30856164
3-(cyclopropylsulfamoyl)-4-methoxy-N-methyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 51933237
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methyl-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide
CID 25359632
3-(chloromethyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
CID 43578962
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methyl-4-methylsulfonylbenzamide
CID 25493349
2-[[3-(cyclopropylsulfamoyl)benzoyl]-ethylamino]acetic acid
CID 119206284
4-amino-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
CID 43575493
4-bromo-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
CID 81295054
N-[(1R)-5-fluoro-2,3-dihydro-1H-inden-1-yl]-N-methylbenzamide
CID 144743792
N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-N-methylbenzamide
CID 18283889
5-bromo-N-(2,3-dihydro-1H-inden-1-yl)-N-methylthiophene-3-carboxamide
CID 47159920

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide (CID 55533364) is 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide is CN(C(=O)c1cccc(S(=O)(=O)NC2CC2)c1)C1CCc2ccccc21.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide?
The InChIKey is QFIMCDKOXJXUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-22(19-12-9-14-5-2-3-8-18(14)19)20(23)15-6-4-7-17(13-15)26(24,25)21-16-10-11-16/h2-8,13,16,19,21H,9-12H2,1H3.
What are the key properties of 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide?
3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide has a molecular weight of 370.47 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide is sourced from PubChem (CID 55533364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).