3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide

C15H15FN2OS — CID 102604414

IUPAC3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide
SMILESO=C(CCSc1ccc(F)cc1)NNc1ccccc1
InChIInChI=1S/C15H15FN2OS/c16-12-6-8-14(9-7-12)20-11-10-15(19)18-17-13-4-2-1-3-5-13/h1-9,17H,10-11H2,(H,18,19)
InChIKeyAUQTZTLTTGPMNN-UHFFFAOYSA-N
MW290.36 g/mol
LogP3.45
Rot. Bonds6

About 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide

3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide (PubChem CID 102604414) has the molecular formula C15H15FN2OS and a molecular weight of 290.36 g/mol. Its IUPAC name is 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide.

Molecular Properties

Compound Name3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide
PubChem CID102604414
Molecular FormulaC15H15FN2OS
Molecular Weight290.36 g/mol
Exact Mass290.09
IUPAC Name3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide
SMILESO=C(CCSc1ccc(F)cc1)NNc1ccccc1
InChIInChI=1S/C15H15FN2OS/c16-12-6-8-14(9-7-12)20-11-10-15(19)18-17-13-4-2-1-3-5-13/h1-9,17H,10-11H2,(H,18,19)
InChIKeyAUQTZTLTTGPMNN-UHFFFAOYSA-N
XLogP3.45
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-benzyl-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea
CID 7977674
2-(4-fluorophenyl)-N'-phenylacetohydrazide
CID 78774551
(2-anilino-2-oxoethyl) 3-(4-fluorophenyl)sulfanylpropanoate
CID 7651113
1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-pyridin-3-ylurea
CID 51282892
2-fluoro-N'-phenylacetohydrazide
CID 16862
3-(4-fluorophenyl)sulfanyl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
CID 17485569
1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-methylphenyl)urea
CID 51179263
N-(4-bromophenyl)-3-(4-fluorophenyl)sulfanylpropanamide
CID 7546484
N'-[2-(2-cyanophenoxy)acetyl]-3-(4-fluorophenyl)sulfanylpropanehydrazide
CID 25435637
3-(4-fluorophenyl)sulfanyl-N-(1-phenylcyclobutyl)propanamide
CID 55462573
1-N',8-N'-diphenyloctanedihydrazide
CID 14872757
N'-acetyl-3-phenylsulfanylpropanehydrazide
CID 30905937

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide?
The IUPAC name of 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide (CID 102604414) is 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide.
What is the SMILES notation for 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide?
The canonical SMILES for 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide is O=C(CCSc1ccc(F)cc1)NNc1ccccc1.
What is the InChIKey of 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide?
The InChIKey is AUQTZTLTTGPMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2OS/c16-12-6-8-14(9-7-12)20-11-10-15(19)18-17-13-4-2-1-3-5-13/h1-9,17H,10-11H2,(H,18,19).
What are the key properties of 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide?
3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide has a molecular weight of 290.36 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)sulfanyl-N'-phenylpropanehydrazide is sourced from PubChem (CID 102604414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).