6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide

C13H16N4O3S — CID 61237307

IUPAC6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCc2ccc(O)cc2)cn1
InChIInChI=1S/C13H16N4O3S/c14-17-13-6-5-12(9-15-13)21(19,20)16-8-7-10-1-3-11(18)4-2-10/h1-6,9,16,18H,7-8,14H2,(H,15,17)
InChIKeyNTQBVSLWICWCOG-UHFFFAOYSA-N
MW308.36 g/mol
LogP0.59
Rot. Bonds6

About 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide

6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide (PubChem CID 61237307) has the molecular formula C13H16N4O3S and a molecular weight of 308.36 g/mol. Its IUPAC name is 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide
PubChem CID61237307
Molecular FormulaC13H16N4O3S
Molecular Weight308.36 g/mol
Exact Mass308.09
IUPAC Name6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCc2ccc(O)cc2)cn1
InChIInChI=1S/C13H16N4O3S/c14-17-13-6-5-12(9-15-13)21(19,20)16-8-7-10-1-3-11(18)4-2-10/h1-6,9,16,18H,7-8,14H2,(H,15,17)
InChIKeyNTQBVSLWICWCOG-UHFFFAOYSA-N
XLogP0.59
TPSA117.34 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 50.59
H-Bond Donors ≤ 54
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

6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide
CID 63826100
N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 10424386
3-amino-4-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide
CID 61237820
N-[2-(4-hydroxyphenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 54903977
3-amino-N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 61239053
6-hydrazinyl-N-(4-methylpentyl)pyridine-3-sulfonamide
CID 63003893
4-amino-3-fluoro-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide
CID 82845702
6-hydrazinyl-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 62990289
N-[2-(4-hydroxyphenyl)ethyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103847923
N-[2-(4-hydroxyphenyl)ethyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 54903976
6-hydrazinyl-N-(4-propan-2-yloxybutyl)pyridine-3-sulfonamide
CID 106012409
3-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide
CID 61017413

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide (CID 61237307) is 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide is NNc1ccc(S(=O)(=O)NCCc2ccc(O)cc2)cn1.
What is the InChIKey of 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide?
The InChIKey is NTQBVSLWICWCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O3S/c14-17-13-6-5-12(9-15-13)21(19,20)16-8-7-10-1-3-11(18)4-2-10/h1-6,9,16,18H,7-8,14H2,(H,15,17).
What are the key properties of 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide?
6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide has a molecular weight of 308.36 g/mol, XLogP of 0.59, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 61237307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).