4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide

C17H20N2O4S — CID 6459980

IUPAC4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-13(12-23-2)18-17(20)14-8-10-15(11-9-14)19-24(21,22)16-6-4-3-5-7-16/h3-11,13,19H,12H2,1-2H3,(H,18,20)
InChIKeyUTBUKOHGAOHLEI-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.25
Rot. Bonds7

About 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide

4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide (PubChem CID 6459980) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
PubChem CID6459980
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-13(12-23-2)18-17(20)14-8-10-15(11-9-14)19-24(21,22)16-6-4-3-5-7-16/h3-11,13,19H,12H2,1-2H3,(H,18,20)
InChIKeyUTBUKOHGAOHLEI-UHFFFAOYSA-N
XLogP2.25
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-fluorophenyl)sulfamoyl]-N-(1-methoxypropan-2-yl)benzamide
CID 46663760
4-benzamido-N-(1-methoxypropan-2-yl)benzamide
CID 17153292
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
4-(benzenesulfonamido)-N-(1-cyclopropylethyl)benzamide
CID 84975243
2-methylpropyl 4-(benzenesulfonamido)benzoate
CID 805921
N-(1-methoxypropan-2-yl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 132702510
N-[4-(2-methoxyethoxy)phenyl]benzenesulfonamide
CID 39874629
2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide
CID 2979282
4-(benzenesulfonamido)-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120653123
N-[(2R)-1-methoxypropan-2-yl]-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 26796911
4-(benzenesulfonamido)-N-[2-(dimethylamino)-3-methylbutyl]benzamide
CID 24650129
4-(benzenesulfonamido)-N-[2-methyl-1-(2-methylphenyl)propyl]benzamide
CID 132666924

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide (CID 6459980) is 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide is COCC(C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide?
The InChIKey is UTBUKOHGAOHLEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-13(12-23-2)18-17(20)14-8-10-15(11-9-14)19-24(21,22)16-6-4-3-5-7-16/h3-11,13,19H,12H2,1-2H3,(H,18,20).
What are the key properties of 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide?
4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide is sourced from PubChem (CID 6459980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).