N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide

C15H18N2O3S — CID 124743837

IUPACN-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide
SMILESCCN([C@H]1CCCc2cccnc21)S(=O)(=O)c1ccco1
InChIInChI=1S/C15H18N2O3S/c1-2-17(21(18,19)14-9-5-11-20-14)13-8-3-6-12-7-4-10-16-15(12)13/h4-5,7,9-11,13H,2-3,6,8H2,1H3/t13-/m0/s1
InChIKeyZFJLKNNAINQSDB-ZDUSSCGKSA-N
MW306.39 g/mol
LogP2.76
Rot. Bonds4

About N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide

N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide (PubChem CID 124743837) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide
PubChem CID124743837
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide
SMILESCCN([C@H]1CCCc2cccnc21)S(=O)(=O)c1ccco1
InChIInChI=1S/C15H18N2O3S/c1-2-17(21(18,19)14-9-5-11-20-14)13-8-3-6-12-7-4-10-16-15(12)13/h4-5,7,9-11,13H,2-3,6,8H2,1H3/t13-/m0/s1
InChIKeyZFJLKNNAINQSDB-ZDUSSCGKSA-N
XLogP2.76
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide?
The IUPAC name of N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide (CID 124743837) is N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide.
What is the SMILES notation for N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide?
The canonical SMILES for N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide is CCN([C@H]1CCCc2cccnc21)S(=O)(=O)c1ccco1.
What is the InChIKey of N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide?
The InChIKey is ZFJLKNNAINQSDB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-2-17(21(18,19)14-9-5-11-20-14)13-8-3-6-12-7-4-10-16-15(12)13/h4-5,7,9-11,13H,2-3,6,8H2,1H3/t13-/m0/s1.
What are the key properties of N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide?
N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide has a molecular weight of 306.39 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]furan-2-sulfonamide is sourced from PubChem (CID 124743837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).