5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide

C20H20N2O3S — CID 58356188

IUPAC5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide
SMILESCN(c1ccc2c(c1)C=C(C(=O)NC1CC1)C2)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H20N2O3S/c1-22(26(24,25)19-5-3-2-4-6-19)18-10-7-14-11-16(12-15(14)13-18)20(23)21-17-8-9-17/h2-7,10,12-13,17H,8-9,11H2,1H3,(H,21,23)
InChIKeyMVDPDBNGTHAAFX-UHFFFAOYSA-N
MW368.46 g/mol
LogP2.73
Rot. Bonds5

About 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide

5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide (PubChem CID 58356188) has the molecular formula C20H20N2O3S and a molecular weight of 368.46 g/mol. Its IUPAC name is 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide.

Molecular Properties

Compound Name5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide
PubChem CID58356188
Molecular FormulaC20H20N2O3S
Molecular Weight368.46 g/mol
Exact Mass368.12
IUPAC Name5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide
SMILESCN(c1ccc2c(c1)C=C(C(=O)NC1CC1)C2)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H20N2O3S/c1-22(26(24,25)19-5-3-2-4-6-19)18-10-7-14-11-16(12-15(14)13-18)20(23)21-17-8-9-17/h2-7,10,12-13,17H,8-9,11H2,1H3,(H,21,23)
InChIKeyMVDPDBNGTHAAFX-UHFFFAOYSA-N
XLogP2.73
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[benzenesulfonyl(cyclopropylmethyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide
CID 58356274
N-[4-(cyclopropylcarbamoyl)phenyl]-3-[methyl(phenyl)sulfamoyl]benzamide
CID 46680640
2-chloro-N-cyclopropyl-5-[(4-fluorophenyl)-methylsulfamoyl]benzamide
CID 27537238
N-cyclohexyl-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2598297
3-[methyl-(4-methylphenyl)sulfamoyl]-N-piperidin-4-ylbenzamide;hydrochloride
CID 119385924
N-[4-(cyclopropylcarbamoylamino)phenyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 46533296
3-[(3-chlorophenyl)-methylsulfamoyl]-N-[4-(cyclopropylcarbamoyl)phenyl]benzamide
CID 46553641
N-(3-fluorophenyl)-N-methylbenzenesulfonamide
CID 64585359
N-cyclopropyl-6-(4-methylpiperidin-1-yl)sulfonyl-1H-indene-2-carboxamide
CID 58356190
4-[[benzenesulfonyl(methyl)amino]methyl]-N-cyclopropylbenzamide
CID 95933789
5-[benzenesulfonyl(methyl)amino]-N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-2-chlorobenzamide
CID 125043024
5-[benzenesulfonyl(methyl)amino]-N-[(2R)-2-bicyclo[2.2.1]heptanyl]-2-chlorobenzamide
CID 133179222

Frequently Asked Questions

What is the IUPAC name of 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide?
The IUPAC name of 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide (CID 58356188) is 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide.
What is the SMILES notation for 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide?
The canonical SMILES for 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide is CN(c1ccc2c(c1)C=C(C(=O)NC1CC1)C2)S(=O)(=O)c1ccccc1.
What is the InChIKey of 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide?
The InChIKey is MVDPDBNGTHAAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3S/c1-22(26(24,25)19-5-3-2-4-6-19)18-10-7-14-11-16(12-15(14)13-18)20(23)21-17-8-9-17/h2-7,10,12-13,17H,8-9,11H2,1H3,(H,21,23).
What are the key properties of 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide?
5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide has a molecular weight of 368.46 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzenesulfonyl(methyl)amino]-N-cyclopropyl-1H-indene-2-carboxamide is sourced from PubChem (CID 58356188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).