1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine

C17H25FN2S — CID 105294406

IUPAC1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine
SMILESCCCCCCCCC(NN)c1cc2ccc(F)cc2s1
InChIInChI=1S/C17H25FN2S/c1-2-3-4-5-6-7-8-15(20-19)17-11-13-9-10-14(18)12-16(13)21-17/h9-12,15,20H,2-8,19H2,1H3
InChIKeyKZVDSXQVQDCUEA-UHFFFAOYSA-N
MW308.47 g/mol
LogP5.30
Rot. Bonds9

About 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine

1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine (PubChem CID 105294406) has the molecular formula C17H25FN2S and a molecular weight of 308.47 g/mol. Its IUPAC name is 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine.

Molecular Properties

Compound Name1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine
PubChem CID105294406
Molecular FormulaC17H25FN2S
Molecular Weight308.47 g/mol
Exact Mass308.17
IUPAC Name1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine
SMILESCCCCCCCCC(NN)c1cc2ccc(F)cc2s1
InChIInChI=1S/C17H25FN2S/c1-2-3-4-5-6-7-8-15(20-19)17-11-13-9-10-14(18)12-16(13)21-17/h9-12,15,20H,2-8,19H2,1H3
InChIKeyKZVDSXQVQDCUEA-UHFFFAOYSA-N
XLogP5.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.47
LogP ≤ 55.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(6-fluoro-1-benzothiophen-2-yl)pentylhydrazine
CID 105293758
1-(6-fluoro-1-benzothiophen-2-yl)-N-methyloctan-1-amine
CID 115832398
1-(6-fluoro-1-benzothiophen-2-yl)nonan-1-amine
CID 115835449
1-(6-fluoro-1-benzothiophen-2-yl)octan-1-ol
CID 115783093
[1-(6-fluoro-1-benzothiophen-2-yl)-5,5-dimethylhexyl]hydrazine
CID 114211702
[1-(6-fluoro-1-benzothiophen-2-yl)-4-methylsulfonylbutyl]hydrazine
CID 105290885
[1-(6-fluoro-1-benzothiophen-2-yl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105283753
[1-(6-fluoro-1-benzothiophen-2-yl)-3-thiophen-3-ylpropyl]hydrazine
CID 105306761
[3-ethyl-1-(5-fluoro-1-benzothiophen-2-yl)heptyl]hydrazine
CID 105288337
1-(5-fluoro-1-benzothiophen-2-yl)nonan-1-ol
CID 105085760
1-(6-fluoro-1-benzothiophen-2-yl)-4-methoxy-N-methylbutan-1-amine
CID 105055088
1-(4-fluorophenyl)undecylhydrazine
CID 105192861

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine?
The IUPAC name of 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine (CID 105294406) is 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine.
What is the SMILES notation for 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine?
The canonical SMILES for 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine is CCCCCCCCC(NN)c1cc2ccc(F)cc2s1.
What is the InChIKey of 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine?
The InChIKey is KZVDSXQVQDCUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2S/c1-2-3-4-5-6-7-8-15(20-19)17-11-13-9-10-14(18)12-16(13)21-17/h9-12,15,20H,2-8,19H2,1H3.
What are the key properties of 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine?
1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine has a molecular weight of 308.47 g/mol, XLogP of 5.30, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-1-benzothiophen-2-yl)nonylhydrazine is sourced from PubChem (CID 105294406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).