[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine

C12H15FN4S — CID 103140305

IUPAC[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(C(CSc2ccc(F)cc2)NN)n1
InChIInChI=1S/C12H15FN4S/c1-17-7-6-11(16-17)12(15-14)8-18-10-4-2-9(13)3-5-10/h2-7,12,15H,8,14H2,1H3
InChIKeyDETRSMLYEOTMKO-UHFFFAOYSA-N
MW266.35 g/mol
LogP1.86
Rot. Bonds5

About [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine

[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 103140305) has the molecular formula C12H15FN4S and a molecular weight of 266.35 g/mol. Its IUPAC name is [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID103140305
Molecular FormulaC12H15FN4S
Molecular Weight266.35 g/mol
Exact Mass266.10
IUPAC Name[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(C(CSc2ccc(F)cc2)NN)n1
InChIInChI=1S/C12H15FN4S/c1-17-7-6-11(16-17)12(15-14)8-18-10-4-2-9(13)3-5-10/h2-7,12,15H,8,14H2,1H3
InChIKeyDETRSMLYEOTMKO-UHFFFAOYSA-N
XLogP1.86
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 51.86
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 [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]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

[1-(1-methylpyrazol-3-yl)-2-phenylsulfanylethyl]hydrazine
CID 103140206
[2-(4-fluorophenyl)sulfanyl-1-pyrimidin-5-ylethyl]hydrazine
CID 105236619
[2-(4-fluorophenyl)sulfanyl-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105236731
1-(1-methylpyrazol-3-yl)pentylhydrazine
CID 105228546
[3-ethyl-1-(1-methylpyrazol-3-yl)pentyl]hydrazine
CID 105228852
[1-(1-methylpyrazol-3-yl)-2-propan-2-yloxyethyl]hydrazine
CID 105228844
3-hydrazinyl-N,N-dimethyl-3-(1-methylpyrazol-3-yl)propan-1-amine
CID 103140522
[1-(3-fluorophenyl)-2-(4-fluorophenyl)sulfanylethyl]hydrazine
CID 105236697
[1-(3,4-difluorophenyl)-2-(4-fluorophenyl)sulfanylethyl]hydrazine
CID 105236679
[2-(2-methylphenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228693
[2-(2-bromo-3-fluorophenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228625
[2-(2,6-dimethylphenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228751

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine (CID 103140305) is [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine is Cn1ccc(C(CSc2ccc(F)cc2)NN)n1.
What is the InChIKey of [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is DETRSMLYEOTMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4S/c1-17-7-6-11(16-17)12(15-14)8-18-10-4-2-9(13)3-5-10/h2-7,12,15H,8,14H2,1H3.
What are the key properties of [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine?
[2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 266.35 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)sulfanyl-1-(1-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 103140305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).