8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide

C22H26N2O5S — CID 3869525

IUPAC8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide
SMILESCCOc1ccc(CCNS(=O)(=O)c2ccc(OCC)c3ncccc23)cc1OC
InChIInChI=1S/C22H26N2O5S/c1-4-28-18-9-8-16(15-20(18)27-3)12-14-24-30(25,26)21-11-10-19(29-5-2)22-17(21)7-6-13-23-22/h6-11,13,15,24H,4-5,12,14H2,1-3H3
InChIKeyGGWXETATDSTIJS-UHFFFAOYSA-N
MW430.53 g/mol
LogP3.56
Rot. Bonds10

About 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide

8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide (PubChem CID 3869525) has the molecular formula C22H26N2O5S and a molecular weight of 430.53 g/mol. Its IUPAC name is 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide.

Molecular Properties

Compound Name8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide
PubChem CID3869525
Molecular FormulaC22H26N2O5S
Molecular Weight430.53 g/mol
Exact Mass430.16
IUPAC Name8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide
SMILESCCOc1ccc(CCNS(=O)(=O)c2ccc(OCC)c3ncccc23)cc1OC
InChIInChI=1S/C22H26N2O5S/c1-4-28-18-9-8-16(15-20(18)27-3)12-14-24-30(25,26)21-11-10-19(29-5-2)22-17(21)7-6-13-23-22/h6-11,13,15,24H,4-5,12,14H2,1-3H3
InChIKeyGGWXETATDSTIJS-UHFFFAOYSA-N
XLogP3.56
TPSA86.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.53
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide 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-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-8-sulfonamide
CID 3734438
8-ethoxy-N-[2-(2-ethoxyphenyl)ethyl]quinoline-5-sulfonamide
CID 3684734
N-[(3,4-dimethoxyphenyl)methyl]-8-methylquinoline-5-sulfonamide
CID 134034376
2-bromo-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]benzenesulfonamide
CID 3482971
N-heptyl-8-methoxyquinoline-5-sulfonamide
CID 594128
N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]-2-nitrobenzenesulfonamide
CID 3836632
N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]-4-(2-methylbutan-2-yl)benzenesulfonamide
CID 3699992
8-ethoxy-N-[3-(4-methylpiperidin-1-yl)propyl]quinoline-5-sulfonamide
CID 126478575
8-methoxy-N-prop-2-enylquinoline-5-sulfonamide
CID 624168
N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide
CID 15998973
8-ethoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]quinoline-5-sulfonamide
CID 25039412
4-methoxy-N-(2-phenylethyl)naphthalene-1-sulfonamide
CID 741442

Frequently Asked Questions

What is the IUPAC name of 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide?
The IUPAC name of 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide (CID 3869525) is 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide.
What is the SMILES notation for 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide?
The canonical SMILES for 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide is CCOc1ccc(CCNS(=O)(=O)c2ccc(OCC)c3ncccc23)cc1OC.
What is the InChIKey of 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide?
The InChIKey is GGWXETATDSTIJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O5S/c1-4-28-18-9-8-16(15-20(18)27-3)12-14-24-30(25,26)21-11-10-19(29-5-2)22-17(21)7-6-13-23-22/h6-11,13,15,24H,4-5,12,14H2,1-3H3.
What are the key properties of 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide?
8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide has a molecular weight of 430.53 g/mol, XLogP of 3.56, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide is sourced from PubChem (CID 3869525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).