N-butyl-3-hydrazinylpyridine-2-sulfonamide

C9H16N4O2S — CID 103300794

IUPACN-butyl-3-hydrazinylpyridine-2-sulfonamide
SMILESCCCCNS(=O)(=O)c1ncccc1NN
InChIInChI=1S/C9H16N4O2S/c1-2-3-7-12-16(14,15)9-8(13-10)5-4-6-11-9/h4-6,12-13H,2-3,7,10H2,1H3
InChIKeyVKPSDYSKPJRDLZ-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.45
Rot. Bonds6

About N-butyl-3-hydrazinylpyridine-2-sulfonamide

N-butyl-3-hydrazinylpyridine-2-sulfonamide (PubChem CID 103300794) has the molecular formula C9H16N4O2S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-butyl-3-hydrazinylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-butyl-3-hydrazinylpyridine-2-sulfonamide
PubChem CID103300794
Molecular FormulaC9H16N4O2S
Molecular Weight244.32 g/mol
Exact Mass244.10
IUPAC NameN-butyl-3-hydrazinylpyridine-2-sulfonamide
SMILESCCCCNS(=O)(=O)c1ncccc1NN
InChIInChI=1S/C9H16N4O2S/c1-2-3-7-12-16(14,15)9-8(13-10)5-4-6-11-9/h4-6,12-13H,2-3,7,10H2,1H3
InChIKeyVKPSDYSKPJRDLZ-UHFFFAOYSA-N
XLogP0.45
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(dimethylamino)butyl]-3-hydrazinylpyridine-2-sulfonamide
CID 103301345
3-hydrazinyl-N-(7-methyloctyl)pyridine-2-sulfonamide
CID 107816644
N-(2,2-dimethylheptyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301827
N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-2-sulfonamide
CID 106340180
3-hydrazinyl-N-[3-(1H-imidazol-2-yl)propyl]pyridine-2-sulfonamide
CID 103302080
N-[(4-ethylphenyl)methyl]-3-hydrazinylpyridine-2-sulfonamide
CID 106900188
3-amino-N-decylpyridine-2-sulfonamide
CID 103306537
N-butyl-2-hydrazinylbenzenesulfonamide
CID 43454845
N-[2-(4-chlorophenyl)ethyl]-3-hydrazinylpyridine-2-sulfonamide
CID 103301054
N-(2,2-difluoroethyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301882
N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300867
3-hydrazinyl-N-(2-methoxy-2-methylpropyl)pyridine-2-sulfonamide
CID 103301999

Frequently Asked Questions

What is the IUPAC name of N-butyl-3-hydrazinylpyridine-2-sulfonamide?
The IUPAC name of N-butyl-3-hydrazinylpyridine-2-sulfonamide (CID 103300794) is N-butyl-3-hydrazinylpyridine-2-sulfonamide.
What is the SMILES notation for N-butyl-3-hydrazinylpyridine-2-sulfonamide?
The canonical SMILES for N-butyl-3-hydrazinylpyridine-2-sulfonamide is CCCCNS(=O)(=O)c1ncccc1NN.
What is the InChIKey of N-butyl-3-hydrazinylpyridine-2-sulfonamide?
The InChIKey is VKPSDYSKPJRDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2S/c1-2-3-7-12-16(14,15)9-8(13-10)5-4-6-11-9/h4-6,12-13H,2-3,7,10H2,1H3.
What are the key properties of N-butyl-3-hydrazinylpyridine-2-sulfonamide?
N-butyl-3-hydrazinylpyridine-2-sulfonamide has a molecular weight of 244.32 g/mol, XLogP of 0.45, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-3-hydrazinylpyridine-2-sulfonamide is sourced from PubChem (CID 103300794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).