2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide

C14H20N4O2S — CID 43456648

IUPAC2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide
SMILESCCCC(C)NS(=O)(=O)c1ccc2nc(NN)ccc2c1
InChIInChI=1S/C14H20N4O2S/c1-3-4-10(2)18-21(19,20)12-6-7-13-11(9-12)5-8-14(16-13)17-15/h5-10,18H,3-4,15H2,1-2H3,(H,16,17)
InChIKeyMWZXXMUZQYUKIR-UHFFFAOYSA-N
MW308.41 g/mol
LogP1.99
Rot. Bonds6

About 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide

2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide (PubChem CID 43456648) has the molecular formula C14H20N4O2S and a molecular weight of 308.41 g/mol. Its IUPAC name is 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide
PubChem CID43456648
Molecular FormulaC14H20N4O2S
Molecular Weight308.41 g/mol
Exact Mass308.13
IUPAC Name2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide
SMILESCCCC(C)NS(=O)(=O)c1ccc2nc(NN)ccc2c1
InChIInChI=1S/C14H20N4O2S/c1-3-4-10(2)18-21(19,20)12-6-7-13-11(9-12)5-8-14(16-13)17-15/h5-10,18H,3-4,15H2,1-2H3,(H,16,17)
InChIKeyMWZXXMUZQYUKIR-UHFFFAOYSA-N
XLogP1.99
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-hydrazinyl-N-(1-methoxypropan-2-yl)quinoline-6-sulfonamide
CID 43456658
N-(1-methoxypropan-2-yl)-2-(methylamino)quinoline-6-sulfonamide
CID 62163537
3,4-dichloro-N-[(2S)-pentan-2-yl]benzenesulfonamide
CID 8893168
2-(methylamino)-N-(3-methylbutan-2-yl)quinoline-6-sulfonamide
CID 62143741
6-(methylamino)-N-pentan-2-ylpyridine-3-sulfonamide
CID 55044216
2-[(2-hydrazinylquinolin-6-yl)sulfonylamino]-N-methylacetamide
CID 43566345
3,4-dimethyl-N-[(2R)-pentan-2-yl]benzenesulfonamide
CID 8893165
3-(aminomethyl)-4-methyl-N-pentan-2-ylbenzenesulfonamide
CID 106046576
2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide
CID 60961716
4-ethyl-N-pentan-2-ylbenzenesulfonamide
CID 19681870
2-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
CID 64605294
2-chloro-N-(1-methoxypropan-2-yl)quinoline-6-sulfonamide
CID 43456723

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide?
The IUPAC name of 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide (CID 43456648) is 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide?
The canonical SMILES for 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide is CCCC(C)NS(=O)(=O)c1ccc2nc(NN)ccc2c1.
What is the InChIKey of 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide?
The InChIKey is MWZXXMUZQYUKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2S/c1-3-4-10(2)18-21(19,20)12-6-7-13-11(9-12)5-8-14(16-13)17-15/h5-10,18H,3-4,15H2,1-2H3,(H,16,17).
What are the key properties of 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide?
2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide has a molecular weight of 308.41 g/mol, XLogP of 1.99, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-pentan-2-ylquinoline-6-sulfonamide is sourced from PubChem (CID 43456648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).