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

C20H24N2O5S — CID 43062290

IUPAC4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1
InChIInChI=1S/C20H24N2O5S/c1-14(18-8-5-13-27-18)21-20(23)15-9-11-16(12-10-15)28(24,25)22-17-6-3-4-7-19(17)26-2/h3-4,6-7,9-12,14,18,22H,5,8,13H2,1-2H3,(H,21,23)
InChIKeyTZJIWGKZMXHMLO-UHFFFAOYSA-N
MW404.49 g/mol
LogP2.79
Rot. Bonds7

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

4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide (PubChem CID 43062290) has the molecular formula C20H24N2O5S and a molecular weight of 404.49 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
PubChem CID43062290
Molecular FormulaC20H24N2O5S
Molecular Weight404.49 g/mol
Exact Mass404.14
IUPAC Name4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1
InChIInChI=1S/C20H24N2O5S/c1-14(18-8-5-13-27-18)21-20(23)15-9-11-16(12-10-15)28(24,25)22-17-6-3-4-7-19(17)26-2/h3-4,6-7,9-12,14,18,22H,5,8,13H2,1-2H3,(H,21,23)
InChIKeyTZJIWGKZMXHMLO-UHFFFAOYSA-N
XLogP2.79
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 75871245
N-[1-(oxolan-2-yl)ethyl]-4-(phenylsulfamoyl)benzamide
CID 46573470
4-[(2-methoxyphenyl)sulfamoyl]-N-(oxolan-2-ylmethyl)benzamide
CID 46652291
4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide
CID 2687763
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-4-phenoxybenzamide
CID 35273707
4-[(2-methoxyphenyl)sulfamoyl]-N-(1-thiophen-2-ylethyl)benzamide
CID 43003138
2-methoxy-N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]-5-sulfamoylbenzamide
CID 35230864
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
N-(1-cyclopropylethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 17467750
N-[1-(oxolan-2-yl)ethyl]-4-propan-2-ylbenzamide
CID 6468560
4-[(2-methoxyphenyl)sulfamoyl]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120832379
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-4-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 55953201

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide (CID 43062290) is 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide.
What is the SMILES notation for 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The canonical SMILES for 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide is COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC(C)C2CCCO2)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
The InChIKey is TZJIWGKZMXHMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5S/c1-14(18-8-5-13-27-18)21-20(23)15-9-11-16(12-10-15)28(24,25)22-17-6-3-4-7-19(17)26-2/h3-4,6-7,9-12,14,18,22H,5,8,13H2,1-2H3,(H,21,23).
What are the key properties of 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide?
4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide has a molecular weight of 404.49 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide is sourced from PubChem (CID 43062290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).