4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide

C19H24N2O4S — CID 34712914

IUPAC4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide
SMILESCOc1ccc(CN(CCOc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1
InChIInChI=1S/C19H24N2O4S/c1-24-17-6-2-15(3-7-17)14-21(16-4-5-16)12-13-25-18-8-10-19(11-9-18)26(20,22)23/h2-3,6-11,16H,4-5,12-14H2,1H3,(H2,20,22,23)
InChIKeyUGNNUIWNVPSFMR-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.39
Rot. Bonds9

About 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide

4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide (PubChem CID 34712914) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide.

Molecular Properties

Compound Name4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide
PubChem CID34712914
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide
SMILESCOc1ccc(CN(CCOc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1
InChIInChI=1S/C19H24N2O4S/c1-24-17-6-2-15(3-7-17)14-21(16-4-5-16)12-13-25-18-8-10-19(11-9-18)26(20,22)23/h2-3,6-11,16H,4-5,12-14H2,1H3,(H2,20,22,23)
InChIKeyUGNNUIWNVPSFMR-UHFFFAOYSA-N
XLogP2.39
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]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

4-[2-[benzyl(cyclopropyl)amino]ethoxy]-N,N-dimethylbenzenesulfonamide
CID 32517776
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methylbenzenesulfonamide
CID 9189457
4-[2-[benzyl(methyl)amino]ethoxy]benzenesulfonamide
CID 34600685
4-[2-(dimethylamino)ethoxy]benzenesulfonamide
CID 22244704
4-[2-[2-methoxyethyl(methyl)amino]ethoxy]benzenesulfonamide
CID 47294827
3,5-dichloro-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]benzenesulfonamide
CID 27664683
1-[[cyclopropyl-[(4-methoxyphenyl)methyl]amino]methyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide
CID 9281789
2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol
CID 62015643
2-(4-sulfamoylphenoxy)ethyl 3-(4-methoxyphenoxy)propanoate
CID 34429524
potassium;hydride;4-methoxybenzenesulfonamide
CID 173359933
N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(4-sulfamoylphenyl)propanamide
CID 46545952
3-[[cyclopropyl-[(4-methoxyphenyl)methyl]amino]methyl]aniline
CID 43460831

Frequently Asked Questions

What is the IUPAC name of 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide?
The IUPAC name of 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide (CID 34712914) is 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide.
What is the SMILES notation for 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide?
The canonical SMILES for 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide is COc1ccc(CN(CCOc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1.
What is the InChIKey of 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide?
The InChIKey is UGNNUIWNVPSFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-24-17-6-2-15(3-7-17)14-21(16-4-5-16)12-13-25-18-8-10-19(11-9-18)26(20,22)23/h2-3,6-11,16H,4-5,12-14H2,1H3,(H2,20,22,23).
What are the key properties of 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide?
4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide has a molecular weight of 376.48 g/mol, XLogP of 2.39, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]ethoxy]benzenesulfonamide is sourced from PubChem (CID 34712914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).