4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide

C21H24N2O3S — CID 113085291

IUPAC4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2(c3c[nH]c4ccc(OC)cc34)CC2)cc1
InChIInChI=1S/C21H24N2O3S/c1-3-15-4-7-17(8-5-15)27(24,25)23-14-21(10-11-21)19-13-22-20-9-6-16(26-2)12-18(19)20/h4-9,12-13,22-23H,3,10-11,14H2,1-2H3
InChIKeyHEYYKOZERZKVLM-UHFFFAOYSA-N
MW384.50 g/mol
LogP3.75
Rot. Bonds7

About 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide

4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide (PubChem CID 113085291) has the molecular formula C21H24N2O3S and a molecular weight of 384.50 g/mol. Its IUPAC name is 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide
PubChem CID113085291
Molecular FormulaC21H24N2O3S
Molecular Weight384.50 g/mol
Exact Mass384.15
IUPAC Name4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2(c3c[nH]c4ccc(OC)cc34)CC2)cc1
InChIInChI=1S/C21H24N2O3S/c1-3-15-4-7-17(8-5-15)27(24,25)23-14-21(10-11-21)19-13-22-20-9-6-16(26-2)12-18(19)20/h4-9,12-13,22-23H,3,10-11,14H2,1-2H3
InChIKeyHEYYKOZERZKVLM-UHFFFAOYSA-N
XLogP3.75
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.50
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide 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

N-[[1-(5-chloro-1H-indol-3-yl)cyclopropyl]methyl]-4-methoxybenzenesulfonamide
CID 113085193
4-ethyl-N-[[1-(6-fluoro-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide
CID 113085390
N-[[1-(5-fluoro-1H-indol-3-yl)cyclopropyl]methyl]ethanesulfonamide
CID 113085086
4-chloro-N-[(5-methoxy-1H-indol-3-yl)methyl]benzenesulfonamide
CID 169029431
N-[[1-(5-fluoro-1H-indol-3-yl)cyclopropyl]methyl]propane-1-sulfonamide
CID 113085087
3,4-dimethoxy-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzamide
CID 113085241
3,4-dichloro-N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide
CID 113084752
N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide
CID 113085260
N-[[1-(5-chloro-1H-indol-3-yl)cyclopropyl]methyl]-2-methylbenzenesulfonamide
CID 113085207
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-nitrobenzenesulfonamide
CID 17271743
N-[[1-(5-fluoro-1H-indol-3-yl)cyclopropyl]methyl]propanamide
CID 113085017
N-[[1-(6-fluoro-1H-indol-3-yl)cyclopropyl]methyl]-2-methoxy-5-methylbenzenesulfonamide
CID 113085398

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide?
The IUPAC name of 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide (CID 113085291) is 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide is CCc1ccc(S(=O)(=O)NCC2(c3c[nH]c4ccc(OC)cc34)CC2)cc1.
What is the InChIKey of 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide?
The InChIKey is HEYYKOZERZKVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3S/c1-3-15-4-7-17(8-5-15)27(24,25)23-14-21(10-11-21)19-13-22-20-9-6-16(26-2)12-18(19)20/h4-9,12-13,22-23H,3,10-11,14H2,1-2H3.
What are the key properties of 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide?
4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide has a molecular weight of 384.50 g/mol, XLogP of 3.75, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzenesulfonamide is sourced from PubChem (CID 113085291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).