4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide

C18H22N2O4S — CID 55948187

IUPAC4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-24-16-9-6-14(7-10-16)18(21)19-15-8-11-17(13(3)12-15)20-25(22,23)5-2/h6-12,20H,4-5H2,1-3H3,(H,19,21)
InChIKeyGENYPVIXNMRTEW-UHFFFAOYSA-N
MW362.45 g/mol
LogP3.41
Rot. Bonds7

About 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide

4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide (PubChem CID 55948187) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide
PubChem CID55948187
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC Name4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-24-16-9-6-14(7-10-16)18(21)19-15-8-11-17(13(3)12-15)20-25(22,23)5-2/h6-12,20H,4-5H2,1-3H3,(H,19,21)
InChIKeyGENYPVIXNMRTEW-UHFFFAOYSA-N
XLogP3.41
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]-1H-indole-2-carboxamide
CID 55947691
3-chloro-4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]-5-methoxybenzamide
CID 55946908
N-(4-ethoxy-2-methylphenyl)ethanesulfonamide
CID 61063373
N-(4-ethoxyphenyl)-3-(methanesulfonamido)-4-methylbenzamide
CID 41465561
2-[4-(4-chlorobenzoyl)phenoxy]-N-[4-(ethylsulfonylamino)-3-methylphenyl]acetamide
CID 55947056
2-(4-chlorophenoxy)-N-[4-(ethylsulfonylamino)-3-methylphenyl]acetamide
CID 47067384
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide
CID 2969739
N-(4-bromo-3,5-dimethylphenyl)-4-ethoxybenzamide
CID 107574997
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-4-ethoxybenzamide
CID 3635933
N-[4-(ethylsulfonylamino)-3-methylphenyl]-3-methoxy-4-phenylmethoxybenzamide
CID 55947038
4-(benzimidazol-1-yl)-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide
CID 55948832
4-ethoxy-N-(4-iodo-2-methylphenyl)benzamide
CID 1350175

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide?
The IUPAC name of 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide (CID 55948187) is 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide is CCOc1ccc(C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cc1.
What is the InChIKey of 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide?
The InChIKey is GENYPVIXNMRTEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-4-24-16-9-6-14(7-10-16)18(21)19-15-8-11-17(13(3)12-15)20-25(22,23)5-2/h6-12,20H,4-5H2,1-3H3,(H,19,21).
What are the key properties of 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide?
4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide has a molecular weight of 362.45 g/mol, XLogP of 3.41, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[4-(ethylsulfonylamino)-3-methylphenyl]benzamide is sourced from PubChem (CID 55948187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).