3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide

C19H22N2O3S — CID 24658427

IUPAC3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide
SMILESCC(C1CC1)N(C)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H22N2O3S/c1-14(15-11-12-15)21(2)19(22)16-7-6-8-17(13-16)20-25(23,24)18-9-4-3-5-10-18/h3-10,13-15,20H,11-12H2,1-2H3
InChIKeyGKFVADYVCNAOPV-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.36
Rot. Bonds6

About 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide

3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide (PubChem CID 24658427) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide
PubChem CID24658427
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide
SMILESCC(C1CC1)N(C)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H22N2O3S/c1-14(15-11-12-15)21(2)19(22)16-7-6-8-17(13-16)20-25(23,24)18-9-4-3-5-10-18/h3-10,13-15,20H,11-12H2,1-2H3
InChIKeyGKFVADYVCNAOPV-UHFFFAOYSA-N
XLogP3.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopropylethyl)-3-(methanesulfonamido)-N-methylbenzamide
CID 42951669
3-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 27670732
3-[[3-(benzenesulfonamido)benzoyl]-propan-2-ylamino]propanoic acid
CID 119206826
3-(benzenesulfonamido)-N,N-dipropylbenzamide
CID 30282516
3-(benzenesulfonamido)-N-cyclopropylbenzamide
CID 17465618
3-(benzenesulfonamido)-N-[2-(dimethylamino)-3-methylbutyl]benzamide
CID 24650130
N-(1-cyclopropylethyl)-N,4-dimethyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 24658420
3-(benzenesulfonamido)-N-[2-(dimethylamino)-2-oxoethyl]benzamide
CID 9305703
3-(benzenesulfonamido)-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
CID 32954431
N-(1-cyclopropylethyl)-N-methyl-9-oxofluorene-2-carboxamide
CID 24658431
3-(benzenesulfonamido)-N-[(3-chlorophenyl)methyl]-N-methylbenzamide
CID 24660209
N-[(1R)-1-cyclopropylethyl]-4-methoxy-N-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 51648761

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide?
The IUPAC name of 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide (CID 24658427) is 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide is CC(C1CC1)N(C)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide?
The InChIKey is GKFVADYVCNAOPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-14(15-11-12-15)21(2)19(22)16-7-6-8-17(13-16)20-25(23,24)18-9-4-3-5-10-18/h3-10,13-15,20H,11-12H2,1-2H3.
What are the key properties of 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide?
3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide has a molecular weight of 358.46 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-(1-cyclopropylethyl)-N-methylbenzamide is sourced from PubChem (CID 24658427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).