3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide

C24H33N3O5S — CID 4832393

IUPAC3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
SMILESCCCN(CCC)S(=O)(=O)c1cccc(C(=O)N(CC)CC(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C24H33N3O5S/c1-5-14-27(15-6-2)33(30,31)22-13-8-10-19(16-22)24(29)26(7-3)18-23(28)25-20-11-9-12-21(17-20)32-4/h8-13,16-17H,5-7,14-15,18H2,1-4H3,(H,25,28)
InChIKeyCGZLJARSFVYFNL-UHFFFAOYSA-N
MW475.61 g/mol
LogP3.61
Rot. Bonds12

About 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide

3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide (PubChem CID 4832393) has the molecular formula C24H33N3O5S and a molecular weight of 475.61 g/mol. Its IUPAC name is 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
PubChem CID4832393
Molecular FormulaC24H33N3O5S
Molecular Weight475.61 g/mol
Exact Mass475.21
IUPAC Name3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
SMILESCCCN(CCC)S(=O)(=O)c1cccc(C(=O)N(CC)CC(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C24H33N3O5S/c1-5-14-27(15-6-2)33(30,31)22-13-8-10-19(16-22)24(29)26(7-3)18-23(28)25-20-11-9-12-21(17-20)32-4/h8-13,16-17H,5-7,14-15,18H2,1-4H3,(H,25,28)
InChIKeyCGZLJARSFVYFNL-UHFFFAOYSA-N
XLogP3.61
TPSA96.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.61
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
CID 7958626
3-(diethylsulfamoyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 27793329
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide
CID 43011197
N-ethyl-2-ethylsulfonyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
CID 55383995
N-ethyl-2,3,4-trimethoxy-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
CID 55344386
2-[ethyl(methylsulfonyl)amino]-N-(3-methoxyphenyl)acetamide
CID 47121758
3-N,3-N-diethyl-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109055870
[3-[(3-methoxybenzoyl)amino]phenyl] 3-(diethylsulfamoyl)benzoate
CID 1250260
2-[(4-bromo-3-methylphenyl)sulfonyl-ethylamino]-N-(3-methoxyphenyl)acetamide
CID 2572082
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 26353614
4-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 120559009
4-chloro-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-3-nitrobenzamide
CID 7769709

Frequently Asked Questions

What is the IUPAC name of 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide?
The IUPAC name of 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide (CID 4832393) is 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide?
The canonical SMILES for 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide is CCCN(CCC)S(=O)(=O)c1cccc(C(=O)N(CC)CC(=O)Nc2cccc(OC)c2)c1.
What is the InChIKey of 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide?
The InChIKey is CGZLJARSFVYFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O5S/c1-5-14-27(15-6-2)33(30,31)22-13-8-10-19(16-22)24(29)26(7-3)18-23(28)25-20-11-9-12-21(17-20)32-4/h8-13,16-17H,5-7,14-15,18H2,1-4H3,(H,25,28).
What are the key properties of 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide?
3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide has a molecular weight of 475.61 g/mol, XLogP of 3.61, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dipropylsulfamoyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 4832393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).