3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide

C26H30N2O5S — CID 24513203

IUPAC3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide
SMILESCCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C26H30N2O5S/c1-5-28(18-20-11-14-23(15-12-20)33-19-21-9-7-6-8-10-21)26(29)22-13-16-24(32-4)25(17-22)34(30,31)27(2)3/h6-17H,5,18-19H2,1-4H3
InChIKeyFQOYNTUEFKHIAN-UHFFFAOYSA-N
MW482.60 g/mol
LogP4.19
Rot. Bonds10

About 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide

3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide (PubChem CID 24513203) has the molecular formula C26H30N2O5S and a molecular weight of 482.60 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide
PubChem CID24513203
Molecular FormulaC26H30N2O5S
Molecular Weight482.60 g/mol
Exact Mass482.19
IUPAC Name3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide
SMILESCCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C26H30N2O5S/c1-5-28(18-20-11-14-23(15-12-20)33-19-21-9-7-6-8-10-21)26(29)22-13-16-24(32-4)25(17-22)34(30,31)27(2)3/h6-17H,5,18-19H2,1-4H3
InChIKeyFQOYNTUEFKHIAN-UHFFFAOYSA-N
XLogP4.19
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.60
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[benzyl(ethyl)amino]-2-oxoethyl] 3-(dimethylsulfamoyl)-4-methoxybenzoate
CID 18267673
N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
4-bromo-3-(dimethylsulfamoyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-ethylbenzamide
CID 24655936
3-(dimethylsulfamoyl)-4-methoxy-N-[[4-[(3-methylphenyl)methoxy]phenyl]methyl]benzamide
CID 46442346
N-benzyl-3-bromo-N-ethyl-4-methoxybenzamide
CID 60660630
N-[(3,4-dimethoxyphenyl)methyl]-4-(dimethylsulfamoyl)-N-ethylbenzamide
CID 8820023
N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-4-phenylmethoxybenzamide
CID 27741024
3-(dimethylsulfamoyl)-4-methoxy-N-methyl-N-phenylbenzamide
CID 51161109
N-ethyl-N-(2-methylprop-2-enyl)-4-phenylmethoxybenzamide
CID 55370161
3-(dimethylsulfamoyl)-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
CID 46585419
N-benzyl-N-ethyl-5-[[(4-ethylbenzoyl)amino]carbamoyl]-2-methoxybenzenesulfonamide
CID 4789084
3-[benzyl(methyl)sulfamoyl]-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methylbenzamide
CID 31986975

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide (CID 24513203) is 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide is CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide?
The InChIKey is FQOYNTUEFKHIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N2O5S/c1-5-28(18-20-11-14-23(15-12-20)33-19-21-9-7-6-8-10-21)26(29)22-13-16-24(32-4)25(17-22)34(30,31)27(2)3/h6-17H,5,18-19H2,1-4H3.
What are the key properties of 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide?
3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide has a molecular weight of 482.60 g/mol, XLogP of 4.19, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-ethyl-4-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide is sourced from PubChem (CID 24513203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).