[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine

C13H15N3OS — CID 79231281

IUPAC[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine
SMILESCSc1ccccc1OCc1cccc(NN)n1
InChIInChI=1S/C13H15N3OS/c1-18-12-7-3-2-6-11(12)17-9-10-5-4-8-13(15-10)16-14/h2-8H,9,14H2,1H3,(H,15,16)
InChIKeyLIABZWHICXWJPV-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.67
Rot. Bonds5

About [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine

[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine (PubChem CID 79231281) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine
PubChem CID79231281
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine
SMILESCSc1ccccc1OCc1cccc(NN)n1
InChIInChI=1S/C13H15N3OS/c1-18-12-7-3-2-6-11(12)17-9-10-5-4-8-13(15-10)16-14/h2-8H,9,14H2,1H3,(H,15,16)
InChIKeyLIABZWHICXWJPV-UHFFFAOYSA-N
XLogP2.67
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.67
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'}

Analyze [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[(6-hydrazinyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 107714111
[6-[(2,3,4,5,6-pentafluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79231511
[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79232587
[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79233690
[6-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 103290222
6-hydrazinyl-N-(2-methylsulfanylphenyl)pyridin-2-amine
CID 107647318
[6-[(3-tert-butylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79230468
[4-[(6-hydrazinyl-2-pyridinyl)methoxy]-3-methoxyphenyl]methanol
CID 107744846
6-[(2-iodophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239369
3-chloro-6-[(2-methylsulfanylphenoxy)methyl]pyridazine
CID 104514236
[6-[(4-chloro-3,5-dimethylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79232634
[6-[(4-bromo-3-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 83140991

Frequently Asked Questions

What is the IUPAC name of [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine (CID 79231281) is [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine is CSc1ccccc1OCc1cccc(NN)n1.
What is the InChIKey of [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine?
The InChIKey is LIABZWHICXWJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-18-12-7-3-2-6-11(12)17-9-10-5-4-8-13(15-10)16-14/h2-8H,9,14H2,1H3,(H,15,16).
What are the key properties of [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine?
[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine has a molecular weight of 261.35 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 79231281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).