2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide

C24H33N3O5S — CID 34960796

IUPAC2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN(Cc2ccc(OC)cc2OC)C2CC2)c1
InChIInChI=1S/C24H33N3O5S/c1-5-27(6-2)33(29,30)22-9-7-8-19(14-22)25-24(28)17-26(20-11-12-20)16-18-10-13-21(31-3)15-23(18)32-4/h7-10,13-15,20H,5-6,11-12,16-17H2,1-4H3,(H,25,28)
InChIKeyNXXWSFJNWSBXEY-UHFFFAOYSA-N
MW475.61 g/mol
LogP3.34
Rot. Bonds12

About 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide

2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide (PubChem CID 34960796) has the molecular formula C24H33N3O5S and a molecular weight of 475.61 g/mol. Its IUPAC name is 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
PubChem CID34960796
Molecular FormulaC24H33N3O5S
Molecular Weight475.61 g/mol
Exact Mass475.21
IUPAC Name2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN(Cc2ccc(OC)cc2OC)C2CC2)c1
InChIInChI=1S/C24H33N3O5S/c1-5-27(6-2)33(29,30)22-9-7-8-19(14-22)25-24(28)17-26(20-11-12-20)16-18-10-13-21(31-3)15-23(18)32-4/h7-10,13-15,20H,5-6,11-12,16-17H2,1-4H3,(H,25,28)
InChIKeyNXXWSFJNWSBXEY-UHFFFAOYSA-N
XLogP3.34
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.61
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(diethylsulfamoyl)anilino]-N-(2,4-dimethoxyphenyl)acetamide
CID 29327817
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetic acid
CID 39364524
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 34978448
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide
CID 34960365
N-cyclopropyl-5-(diethylsulfamoyl)-N-[(2,4-dimethoxyphenyl)methyl]-2-methylbenzamide
CID 32588710
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-(3-methoxyphenyl)acetamide
CID 8007102
2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
CID 60513356
N-(3-acetamidophenyl)-2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 86908948
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
CID 46602367
N-(3-bromophenyl)-2-[ethyl-(4-methoxyphenyl)sulfonylamino]acetamide
CID 3510493
(2,4-dimethoxyphenyl)methyl-methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium
CID 8845921
2-[ethyl(methylsulfonyl)amino]-N-(3-methoxyphenyl)acetamide
CID 47121758

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide (CID 34960796) is 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)CN(Cc2ccc(OC)cc2OC)C2CC2)c1.
What is the InChIKey of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide?
The InChIKey is NXXWSFJNWSBXEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O5S/c1-5-27(6-2)33(29,30)22-9-7-8-19(14-22)25-24(28)17-26(20-11-12-20)16-18-10-13-21(31-3)15-23(18)32-4/h7-10,13-15,20H,5-6,11-12,16-17H2,1-4H3,(H,25,28).
What are the key properties of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide?
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide has a molecular weight of 475.61 g/mol, XLogP of 3.34, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 34960796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).