4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide

C20H24N2O4S — CID 75871245

IUPAC4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1
InChIInChI=1S/C20H24N2O4S/c1-14-6-3-4-7-18(14)22-27(24,25)17-11-9-16(10-12-17)20(23)21-15(2)19-8-5-13-26-19/h3-4,6-7,9-12,15,19,22H,5,8,13H2,1-2H3,(H,21,23)
InChIKeyDKPAFWAURFTCDR-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.09
Rot. Bonds6

About 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide

4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide (PubChem CID 75871245) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
PubChem CID75871245
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1
InChIInChI=1S/C20H24N2O4S/c1-14-6-3-4-7-18(14)22-27(24,25)17-11-9-16(10-12-17)20(23)21-15(2)19-8-5-13-26-19/h3-4,6-7,9-12,15,19,22H,5,8,13H2,1-2H3,(H,21,23)
InChIKeyDKPAFWAURFTCDR-UHFFFAOYSA-N
XLogP3.09
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43062290
N-[1-(oxolan-2-yl)ethyl]-4-(phenylsulfamoyl)benzamide
CID 46573470
N-(1-cyclopropylethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 17467750
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
2-[2-[4-[(2-methylphenyl)sulfamoyl]benzoyl]hydrazinyl]-2-oxo-N-propan-2-ylacetamide
CID 9305972
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-4-phenoxybenzamide
CID 35273707
N-[1-(oxolan-2-yl)ethyl]-4-propan-2-ylbenzamide
CID 6468560
N-(2-methylphenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9342166
2-methyl-5-[1-(oxolan-2-yl)ethylcarbamoyl]benzenesulfonyl chloride
CID 65371905
3-[1-(oxolan-2-yl)ethylcarbamoyl]benzenesulfonyl chloride
CID 43533927
N-(2-methylcyclohexyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 42992273
4-(chloromethyl)-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43533877

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The IUPAC name of 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide (CID 75871245) is 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide.
What is the SMILES notation for 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The canonical SMILES for 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide is Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1.
What is the InChIKey of 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The InChIKey is DKPAFWAURFTCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-14-6-3-4-7-18(14)22-27(24,25)17-11-9-16(10-12-17)20(23)21-15(2)19-8-5-13-26-19/h3-4,6-7,9-12,15,19,22H,5,8,13H2,1-2H3,(H,21,23).
What are the key properties of 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide has a molecular weight of 388.49 g/mol, XLogP of 3.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide is sourced from PubChem (CID 75871245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).