[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

C16H15FN2S — CID 105325318

IUPAC[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2csc3ccccc23)c1
InChIInChI=1S/C16H15FN2S/c1-10-6-11(8-12(17)7-10)16(19-18)14-9-20-15-5-3-2-4-13(14)15/h2-9,16,19H,18H2,1H3
InChIKeyLMGDBTMMKBYWGX-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.90
Rot. Bonds3

About [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (PubChem CID 105325318) has the molecular formula C16H15FN2S and a molecular weight of 286.38 g/mol. Its IUPAC name is [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
PubChem CID105325318
Molecular FormulaC16H15FN2S
Molecular Weight286.38 g/mol
Exact Mass286.09
IUPAC Name[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2csc3ccccc23)c1
InChIInChI=1S/C16H15FN2S/c1-10-6-11(8-12(17)7-10)16(19-18)14-9-20-15-5-3-2-4-13(14)15/h2-9,16,19H,18H2,1H3
InChIKeyLMGDBTMMKBYWGX-UHFFFAOYSA-N
XLogP3.90
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305524
[1-benzothiophen-3-yl(pyrimidin-5-yl)methyl]hydrazine
CID 105292167
[1-benzothiophen-3-yl-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105303991
[1-benzothiophen-3-yl-(2-chloro-5-fluorophenyl)methyl]hydrazine
CID 105398126
[1-benzothiophen-3-yl-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 103397828
[(5-chloro-2-fluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105280252
2-(1-benzothiophen-3-yl)-2-(3-fluoro-5-methylanilino)ethanol
CID 79046382
1-(1-benzothiophen-3-yl)-1-(5-fluoro-2-methylphenyl)-N-methylmethanamine
CID 63049999
[1-benzothiophen-3-yl-(3-bromo-2-fluorophenyl)methyl]hydrazine
CID 106649802
[1-benzothiophen-3-yl-(4-bromo-3-chloro-2-fluorophenyl)methyl]hydrazine
CID 106765556
[(2-bromo-3,4-difluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 107541248
[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254568

Frequently Asked Questions

What is the IUPAC name of [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (CID 105325318) is [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is Cc1cc(F)cc(C(NN)c2csc3ccccc23)c1.
What is the InChIKey of [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The InChIKey is LMGDBTMMKBYWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2S/c1-10-6-11(8-12(17)7-10)16(19-18)14-9-20-15-5-3-2-4-13(14)15/h2-9,16,19H,18H2,1H3.
What are the key properties of [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
[1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine has a molecular weight of 286.38 g/mol, XLogP of 3.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-3-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105325318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).