8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide

C15H19N3O3S — CID 95568609

IUPAC8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide
SMILESNS(=O)(=O)c1ccc(NCC[C@H]2CCCO2)c2ncccc12
InChIInChI=1S/C15H19N3O3S/c16-22(19,20)14-6-5-13(15-12(14)4-1-8-18-15)17-9-7-11-3-2-10-21-11/h1,4-6,8,11,17H,2-3,7,9-10H2,(H2,16,19,20)/t11-/m1/s1
InChIKeyRATMGCYRZFTWBB-LLVKDONJSA-N
MW321.40 g/mol
LogP1.86
Rot. Bonds5

About 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide

8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide (PubChem CID 95568609) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide.

Molecular Properties

Compound Name8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide
PubChem CID95568609
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC Name8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide
SMILESNS(=O)(=O)c1ccc(NCC[C@H]2CCCO2)c2ncccc12
InChIInChI=1S/C15H19N3O3S/c16-22(19,20)14-6-5-13(15-12(14)4-1-8-18-15)17-9-7-11-3-2-10-21-11/h1,4-6,8,11,17H,2-3,7,9-10H2,(H2,16,19,20)/t11-/m1/s1
InChIKeyRATMGCYRZFTWBB-LLVKDONJSA-N
XLogP1.86
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 8-[2-[(2R)-oxolan-2-yl]ethylamino]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

4-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-8-carboxylic acid
CID 167745414
N-[(5-bromoquinolin-8-yl)methyl]-2-(oxolan-2-yl)ethanamine
CID 115959209
2-bromo-N-[2-(oxolan-2-yl)ethyl]aniline
CID 63181267
3-fluoro-4-[2-(oxan-2-yl)ethylamino]benzenesulfonamide
CID 106000014
8-[[2-(3-methylbutoxy)cyclohexyl]amino]quinoline-5-sulfonamide
CID 75390876
4-[2-(oxolan-2-yl)ethylamino]quinoline-2-carboxylic acid
CID 63377382
N-[[(2S)-oxolan-2-yl]methyl]quinoline-8-sulfonamide
CID 704975
2-[(5-chloroquinolin-8-yl)amino]ethanesulfonamide
CID 114384833
2-methyl-3-N-[2-(oxolan-2-yl)ethyl]benzene-1,3-diamine
CID 63062740
2-N-[2-(oxolan-2-yl)ethyl]pyrazine-2,5-diamine
CID 80652214
N-methyl-N-(oxolan-2-ylmethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103305237
2-bromo-N-[2-(oxolan-2-yl)ethyl]benzenesulfonamide
CID 51076370

Frequently Asked Questions

What is the IUPAC name of 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide?
The IUPAC name of 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide (CID 95568609) is 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide.
What is the SMILES notation for 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide?
The canonical SMILES for 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide is NS(=O)(=O)c1ccc(NCC[C@H]2CCCO2)c2ncccc12.
What is the InChIKey of 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide?
The InChIKey is RATMGCYRZFTWBB-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19N3O3S/c16-22(19,20)14-6-5-13(15-12(14)4-1-8-18-15)17-9-7-11-3-2-10-21-11/h1,4-6,8,11,17H,2-3,7,9-10H2,(H2,16,19,20)/t11-/m1/s1.
What are the key properties of 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide?
8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide has a molecular weight of 321.40 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[(2R)-oxolan-2-yl]ethylamino]quinoline-5-sulfonamide is sourced from PubChem (CID 95568609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).