N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide

C18H22N2O5S — CID 9102814

IUPACN-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OCC)c(OC)c2)cc1
InChIInChI=1S/C18H22N2O5S/c1-4-19-26(22,23)15-9-6-13(7-10-15)18(21)20-14-8-11-16(25-5-2)17(12-14)24-3/h6-12,19H,4-5H2,1-3H3,(H,20,21)
InChIKeyMICLUXJTJCQIHP-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.64
Rot. Bonds8

About N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide

N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide (PubChem CID 9102814) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide
PubChem CID9102814
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC NameN-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OCC)c(OC)c2)cc1
InChIInChI=1S/C18H22N2O5S/c1-4-19-26(22,23)15-9-6-13(7-10-15)18(21)20-14-8-11-16(25-5-2)17(12-14)24-3/h6-12,19H,4-5H2,1-3H3,(H,20,21)
InChIKeyMICLUXJTJCQIHP-UHFFFAOYSA-N
XLogP2.64
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-N,4-N-bis(4-ethoxy-3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 24645019
N-(3,4-dipropoxyphenyl)-4-(ethylsulfamoyl)benzamide
CID 26878614
N-(3,4-diethoxyphenyl)-4-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26878798
N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
CID 9416096
4-(ethylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 9411925
4-ethoxy-N-[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyphenyl]-3-methoxybenzamide
CID 31307715
4-(benzenesulfonamido)-N-(3,4-diethoxyphenyl)benzamide
CID 43009389
N-[3-(butylsulfamoyl)phenyl]-4-ethoxy-3-methoxybenzamide
CID 26698637
4-[[(4-ethoxy-3-methoxybenzoyl)amino]carbamoyl]-N-prop-2-ynylbenzenesulfonamide
CID 33316587
N-(3-ethoxy-4-methoxyphenyl)-4-fluorobenzamide
CID 60794299
4-ethoxy-3-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 26698623
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide?
The IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide (CID 9102814) is N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide?
The canonical SMILES for N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide is CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OCC)c(OC)c2)cc1.
What is the InChIKey of N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide?
The InChIKey is MICLUXJTJCQIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-4-19-26(22,23)15-9-6-13(7-10-15)18(21)20-14-8-11-16(25-5-2)17(12-14)24-3/h6-12,19H,4-5H2,1-3H3,(H,20,21).
What are the key properties of N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide?
N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide has a molecular weight of 378.45 g/mol, XLogP of 2.64, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide is sourced from PubChem (CID 9102814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).