5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide

C22H27N3O3S — CID 50801974

IUPAC5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide
SMILESCCn1c(C(=O)NCC(C)c2ccccc2)cc2cc(S(=O)(=O)N(C)C)ccc21
InChIInChI=1S/C22H27N3O3S/c1-5-25-20-12-11-19(29(27,28)24(3)4)13-18(20)14-21(25)22(26)23-15-16(2)17-9-7-6-8-10-17/h6-14,16H,5,15H2,1-4H3,(H,23,26)
InChIKeyZASXDIZARBYLHU-UHFFFAOYSA-N
MW413.54 g/mol
LogP3.44
Rot. Bonds7

About 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide

5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide (PubChem CID 50801974) has the molecular formula C22H27N3O3S and a molecular weight of 413.54 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide
PubChem CID50801974
Molecular FormulaC22H27N3O3S
Molecular Weight413.54 g/mol
Exact Mass413.18
IUPAC Name5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide
SMILESCCn1c(C(=O)NCC(C)c2ccccc2)cc2cc(S(=O)(=O)N(C)C)ccc21
InChIInChI=1S/C22H27N3O3S/c1-5-25-20-12-11-19(29(27,28)24(3)4)13-18(20)14-21(25)22(26)23-15-16(2)17-9-7-6-8-10-17/h6-14,16H,5,15H2,1-4H3,(H,23,26)
InChIKeyZASXDIZARBYLHU-UHFFFAOYSA-N
XLogP3.44
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.54
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide 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

4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
1-ethyl-N,N-dimethyl-2-(pyrrolidine-1-carbonyl)indole-5-sulfonamide
CID 50801918
1-benzyl-5-(dimethylsulfamoyl)-N-(pyridin-2-ylmethyl)indole-2-carboxamide
CID 50802080
3-(dimethylsulfamoyl)-N-[2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl]benzamide
CID 8624154
1-benzyl-5-(dimethylsulfamoyl)-N-[(5-methylfuran-2-yl)methyl]indole-2-carboxamide
CID 50801746
5-(dimethylsulfamoyl)-N-(2-methoxyethyl)-1-prop-2-enylindole-2-carboxamide
CID 50802007
5-(dimethylsulfamoyl)-1-ethyl-N-[3-[(3R)-3-methylpiperidin-1-yl]propyl]indole-2-carboxamide
CID 93076605
1-benzyl-5-(dimethylsulfamoyl)-N-(3-piperidin-1-ylpropyl)indole-2-carboxamide
CID 50801822
5-(dimethylsulfamoyl)-1-methyl-N-[(2S)-4-phenylbutan-2-yl]indole-2-carboxamide
CID 93076590
5-(diethylsulfamoyl)-2-fluoro-N-[(2R)-2-phenylpropyl]benzamide
CID 9301737
N-benzhydryl-3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanamide
CID 4876131
[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 2-benzamidopropanoate
CID 24684554

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide?
The IUPAC name of 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide (CID 50801974) is 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide is CCn1c(C(=O)NCC(C)c2ccccc2)cc2cc(S(=O)(=O)N(C)C)ccc21.
What is the InChIKey of 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide?
The InChIKey is ZASXDIZARBYLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3S/c1-5-25-20-12-11-19(29(27,28)24(3)4)13-18(20)14-21(25)22(26)23-15-16(2)17-9-7-6-8-10-17/h6-14,16H,5,15H2,1-4H3,(H,23,26).
What are the key properties of 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide?
5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide has a molecular weight of 413.54 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-1-ethyl-N-(2-phenylpropyl)indole-2-carboxamide is sourced from PubChem (CID 50801974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).