N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide

C18H22N2O6S — CID 9192356

IUPACN-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)OC)c1
InChIInChI=1S/C18H22N2O6S/c1-5-26-15-9-7-6-8-14(15)19-18(21)13-10-11-16(24-3)17(12-13)27(22,23)20(2)25-4/h6-12H,5H2,1-4H3,(H,19,21)
InChIKeyAYYHXAXCUNNSDH-UHFFFAOYSA-N
MW394.45 g/mol
LogP2.53
Rot. Bonds8

About N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide

N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide (PubChem CID 9192356) has the molecular formula C18H22N2O6S and a molecular weight of 394.45 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide
PubChem CID9192356
Molecular FormulaC18H22N2O6S
Molecular Weight394.45 g/mol
Exact Mass394.12
IUPAC NameN-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)OC)c1
InChIInChI=1S/C18H22N2O6S/c1-5-26-15-9-7-6-8-14(15)19-18(21)13-10-11-16(24-3)17(12-13)27(22,23)20(2)25-4/h6-12H,5H2,1-4H3,(H,19,21)
InChIKeyAYYHXAXCUNNSDH-UHFFFAOYSA-N
XLogP2.53
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)-4-methylbenzamide
CID 110295913
3-(dimethylsulfamoyl)-4-methoxy-N-[2-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 55508199
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
1-N,3-N-bis(2-ethoxyphenyl)-4-methoxybenzene-1,3-dicarboxamide
CID 141155437
N-(5-fluoro-2-methylphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide
CID 17459398
4-chloro-N-[2-(2-chlorophenoxy)phenyl]-3-[methoxy(methyl)sulfamoyl]benzamide
CID 37348272
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
3-(diethylsulfamoyl)-N-(2-ethylsulfonylphenyl)-4-methoxybenzamide
CID 55613417
N-(2-ethoxyphenyl)-4-methoxy-3-nitrobenzamide
CID 711588
4-methoxy-3-[methoxy(methyl)sulfamoyl]-N-(4-methyl-2-pyridinyl)benzamide
CID 17443500
4-ethoxy-3-methoxy-N-(2-phenoxyphenyl)benzamide
CID 24583790
3-ethoxy-N-(2-methoxyphenyl)-4-phenylmethoxybenzamide
CID 126087524

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide (CID 9192356) is N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide is CCOc1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)OC)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide?
The InChIKey is AYYHXAXCUNNSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O6S/c1-5-26-15-9-7-6-8-14(15)19-18(21)13-10-11-16(24-3)17(12-13)27(22,23)20(2)25-4/h6-12H,5H2,1-4H3,(H,19,21).
What are the key properties of N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide?
N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide has a molecular weight of 394.45 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-methoxy-3-[methoxy(methyl)sulfamoyl]benzamide is sourced from PubChem (CID 9192356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).