N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide

C14H18N4O2S — CID 106900184

IUPACN-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide
SMILESCCc1ccc(CNS(=O)(=O)c2ccnc(NN)c2)cc1
InChIInChI=1S/C14H18N4O2S/c1-2-11-3-5-12(6-4-11)10-17-21(19,20)13-7-8-16-14(9-13)18-15/h3-9,17H,2,10,15H2,1H3,(H,16,18)
InChIKeyYUHYTENOEPGAEZ-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.41
Rot. Bonds6

About N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide

N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide (PubChem CID 106900184) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide
PubChem CID106900184
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC NameN-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide
SMILESCCc1ccc(CNS(=O)(=O)c2ccnc(NN)c2)cc1
InChIInChI=1S/C14H18N4O2S/c1-2-11-3-5-12(6-4-11)10-17-21(19,20)13-7-8-16-14(9-13)18-15/h3-9,17H,2,10,15H2,1H3,(H,16,18)
InChIKeyYUHYTENOEPGAEZ-UHFFFAOYSA-N
XLogP1.41
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.41
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

N-[(4-chlorophenyl)methyl]-2-(methylamino)pyridine-4-sulfonamide
CID 62164890
N-[(4-ethylphenyl)methyl]-4-hydrazinylbenzenesulfonamide
CID 106900182
2-(propylamino)-N-(pyridin-4-ylmethyl)pyridine-4-sulfonamide
CID 62148405
N-[(2-fluorophenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide
CID 61003915
2-hydrazinyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-4-sulfonamide
CID 55037929
2-hydrazinyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-4-sulfonamide
CID 114184093
2-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-4-sulfonamide
CID 61004239
N-(2-ethoxy-2-methylpropyl)-2-hydrazinylpyridine-4-sulfonamide
CID 114943123
N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridin-4-amine
CID 106901053
N-(2-cyclopentylethyl)-2-hydrazinylpyridine-4-sulfonamide
CID 54895638
N-[(4-ethylphenyl)methyl]-3-hydrazinylpyridine-2-sulfonamide
CID 106900188
N-tert-butyl-2-[(2-hydrazinyl-4-pyridinyl)sulfonylamino]acetamide
CID 115356562

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide (CID 106900184) is N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide is CCc1ccc(CNS(=O)(=O)c2ccnc(NN)c2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide?
The InChIKey is YUHYTENOEPGAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c1-2-11-3-5-12(6-4-11)10-17-21(19,20)13-7-8-16-14(9-13)18-15/h3-9,17H,2,10,15H2,1H3,(H,16,18).
What are the key properties of N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide?
N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide has a molecular weight of 306.39 g/mol, XLogP of 1.41, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-2-hydrazinylpyridine-4-sulfonamide is sourced from PubChem (CID 106900184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).