N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide

C12H22N4O2S — CID 79469996

IUPACN-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide
SMILESCCC(C)CN(CC)S(=O)(=O)c1ccc(NN)nc1
InChIInChI=1S/C12H22N4O2S/c1-4-10(3)9-16(5-2)19(17,18)11-6-7-12(15-13)14-8-11/h6-8,10H,4-5,9,13H2,1-3H3,(H,14,15)
InChIKeyRGSFBUAAMCPIGR-UHFFFAOYSA-N
MW286.40 g/mol
LogP1.42
Rot. Bonds7

About N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide

N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide (PubChem CID 79469996) has the molecular formula C12H22N4O2S and a molecular weight of 286.40 g/mol. Its IUPAC name is N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide
PubChem CID79469996
Molecular FormulaC12H22N4O2S
Molecular Weight286.40 g/mol
Exact Mass286.15
IUPAC NameN-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide
SMILESCCC(C)CN(CC)S(=O)(=O)c1ccc(NN)nc1
InChIInChI=1S/C12H22N4O2S/c1-4-10(3)9-16(5-2)19(17,18)11-6-7-12(15-13)14-8-11/h6-8,10H,4-5,9,13H2,1-3H3,(H,14,15)
InChIKeyRGSFBUAAMCPIGR-UHFFFAOYSA-N
XLogP1.42
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 51.42
H-Bond Donors ≤ 52
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

N-butan-2-yl-N-ethyl-6-hydrazinylpyridine-3-sulfonamide
CID 43274843
N-ethyl-N-(2-methylpropyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143975
N-ethyl-N-(2-methylbutyl)-2-(propylamino)pyrimidine-5-sulfonamide
CID 79481846
4-[ethyl(2-methylbutyl)sulfamoyl]benzenesulfonyl fluoride
CID 114791690
N-ethyl-4-(ethylaminomethyl)-N-(2-methylbutyl)benzenesulfonamide
CID 79479965
N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61437323
6-anilino-N,N-diethylpyridine-3-sulfonamide
CID 829839
6-hydrazinyl-N-(4-methylpentyl)pyridine-3-sulfonamide
CID 63003893
6-(butan-2-ylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113250552
N,N-diethyl-6-(4-ethylanilino)pyridine-3-sulfonamide
CID 5267715
N,N-diethyl-6-(4-iodoanilino)pyridine-3-sulfonamide
CID 5267788
N,N-diethyl-6-(4-fluoroanilino)pyridine-3-sulfonamide
CID 5267789

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide?
The IUPAC name of N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide (CID 79469996) is N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide?
The canonical SMILES for N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide is CCC(C)CN(CC)S(=O)(=O)c1ccc(NN)nc1.
What is the InChIKey of N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide?
The InChIKey is RGSFBUAAMCPIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2S/c1-4-10(3)9-16(5-2)19(17,18)11-6-7-12(15-13)14-8-11/h6-8,10H,4-5,9,13H2,1-3H3,(H,14,15).
What are the key properties of N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide?
N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide has a molecular weight of 286.40 g/mol, XLogP of 1.42, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-hydrazinyl-N-(2-methylbutyl)pyridine-3-sulfonamide is sourced from PubChem (CID 79469996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).