N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide

C14H19N3O3S — CID 62163537

IUPACN-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide
SMILESCNc1ccc2cc(S(=O)(=O)NC(C)COC)ccc2n1
InChIInChI=1S/C14H19N3O3S/c1-10(9-20-3)17-21(18,19)12-5-6-13-11(8-12)4-7-14(15-2)16-13/h4-8,10,17H,9H2,1-3H3,(H,15,16)
InChIKeyWEDLIYJRPKKZLC-UHFFFAOYSA-N
MW309.39 g/mol
LogP1.59
Rot. Bonds6

About N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide

N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide (PubChem CID 62163537) has the molecular formula C14H19N3O3S and a molecular weight of 309.39 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide
PubChem CID62163537
Molecular FormulaC14H19N3O3S
Molecular Weight309.39 g/mol
Exact Mass309.11
IUPAC NameN-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide
SMILESCNc1ccc2cc(S(=O)(=O)NC(C)COC)ccc2n1
InChIInChI=1S/C14H19N3O3S/c1-10(9-20-3)17-21(18,19)12-5-6-13-11(8-12)4-7-14(15-2)16-13/h4-8,10,17H,9H2,1-3H3,(H,15,16)
InChIKeyWEDLIYJRPKKZLC-UHFFFAOYSA-N
XLogP1.59
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-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

2-hydrazinyl-N-(1-methoxypropan-2-yl)quinoline-6-sulfonamide
CID 43456658
2-chloro-N-(1-methoxypropan-2-yl)quinoline-6-sulfonamide
CID 43456723
2-(methylamino)-N-(3-methylbutan-2-yl)quinoline-6-sulfonamide
CID 62143741
2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide
CID 43456648
N-ethyl-2-(methylamino)-N-propan-2-ylquinoline-6-sulfonamide
CID 62145303
N-(2,2-difluoroethyl)-2-(methylamino)quinoline-6-sulfonamide
CID 115408548
N-(1-methoxypropan-2-yl)-2-oxochromene-6-sulfonamide
CID 134062008
4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzenesulfonamide
CID 884361
2-chloro-N-(1-methoxypropan-2-yl)pyridine-4-sulfonamide
CID 61004005
3-chloro-4-fluoro-N-(1-methoxypropan-2-yl)benzenesulfonamide
CID 5184702
N-(1-methoxypropan-2-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 51170060
4-ethyl-N-(1-methoxypropan-2-yl)benzenesulfonamide
CID 51183649

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide (CID 62163537) is N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide is CNc1ccc2cc(S(=O)(=O)NC(C)COC)ccc2n1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide?
The InChIKey is WEDLIYJRPKKZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3S/c1-10(9-20-3)17-21(18,19)12-5-6-13-11(8-12)4-7-14(15-2)16-13/h4-8,10,17H,9H2,1-3H3,(H,15,16).
What are the key properties of N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide?
N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide has a molecular weight of 309.39 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide is sourced from PubChem (CID 62163537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).