2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide

C12H16N4O3S — CID 60961716

IUPAC2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide
SMILESCN(CCO)S(=O)(=O)c1ccc2nc(NN)ccc2c1
InChIInChI=1S/C12H16N4O3S/c1-16(6-7-17)20(18,19)10-3-4-11-9(8-10)2-5-12(14-11)15-13/h2-5,8,17H,6-7,13H2,1H3,(H,14,15)
InChIKeyOGFMWIHNHYPIRD-UHFFFAOYSA-N
MW296.35 g/mol
LogP0.13
Rot. Bonds5

About 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide

2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide (PubChem CID 60961716) has the molecular formula C12H16N4O3S and a molecular weight of 296.35 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide
PubChem CID60961716
Molecular FormulaC12H16N4O3S
Molecular Weight296.35 g/mol
Exact Mass296.09
IUPAC Name2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide
SMILESCN(CCO)S(=O)(=O)c1ccc2nc(NN)ccc2c1
InChIInChI=1S/C12H16N4O3S/c1-16(6-7-17)20(18,19)10-3-4-11-9(8-10)2-5-12(14-11)15-13/h2-5,8,17H,6-7,13H2,1H3,(H,14,15)
InChIKeyOGFMWIHNHYPIRD-UHFFFAOYSA-N
XLogP0.13
TPSA108.55 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-cyanoethyl)-2-hydrazinyl-N-methylquinoline-6-sulfonamide
CID 43456727
N-methyl-2-(methylamino)-N-(2-methylsulfanylethyl)quinoline-6-sulfonamide
CID 115987134
2-[(2-hydrazinylquinolin-6-yl)sulfonylamino]-N-methylacetamide
CID 43566345
N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62146541
N-(2-hydroxyethyl)-N-methyl-2-oxochromene-6-sulfonamide
CID 54879507
2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide
CID 43456648
4-bromo-3-fluoro-N-(2-hydroxyethyl)-N-methylbenzenesulfonamide
CID 103833706
3-amino-4-chloro-N-(2-hydroxyethyl)-N-methylbenzenesulfonamide
CID 43345894
2-hydrazinyl-N-(1-methoxypropan-2-yl)quinoline-6-sulfonamide
CID 43456658
N-ethyl-2-(methylamino)-N-propan-2-ylquinoline-6-sulfonamide
CID 62145303
2-amino-N-(2,2-dimethylpropyl)-N-methylquinoline-6-sulfonamide
CID 62152213
4-chloro-N-(2-hydroxyethyl)-N,3-dimethylbenzenesulfonamide
CID 39363651

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide?
The IUPAC name of 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide (CID 60961716) is 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide is CN(CCO)S(=O)(=O)c1ccc2nc(NN)ccc2c1.
What is the InChIKey of 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide?
The InChIKey is OGFMWIHNHYPIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O3S/c1-16(6-7-17)20(18,19)10-3-4-11-9(8-10)2-5-12(14-11)15-13/h2-5,8,17H,6-7,13H2,1H3,(H,14,15).
What are the key properties of 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide?
2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide has a molecular weight of 296.35 g/mol, XLogP of 0.13, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide is sourced from PubChem (CID 60961716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).