[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine

C14H12FN3S — CID 105258549

IUPAC[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccncc1F)c1cccc2ccsc12
InChIInChI=1S/C14H12FN3S/c15-12-8-17-6-4-10(12)13(18-16)11-3-1-2-9-5-7-19-14(9)11/h1-8,13,18H,16H2
InChIKeyLYZLDUAPCWKWCA-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.99
Rot. Bonds3

About [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine

[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 105258549) has the molecular formula C14H12FN3S and a molecular weight of 273.34 g/mol. Its IUPAC name is [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine
PubChem CID105258549
Molecular FormulaC14H12FN3S
Molecular Weight273.34 g/mol
Exact Mass273.07
IUPAC Name[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccncc1F)c1cccc2ccsc12
InChIInChI=1S/C14H12FN3S/c15-12-8-17-6-4-10(12)13(18-16)11-3-1-2-9-5-7-19-14(9)11/h1-8,13,18H,16H2
InChIKeyLYZLDUAPCWKWCA-UHFFFAOYSA-N
XLogP2.99
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-7-yl-(2,3-difluorophenyl)methyl]hydrazine
CID 105327729
[1-benzothiophen-7-yl-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105327623
[1-benzothiophen-7-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
CID 105280614
[(2-fluoro-3-methylphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335451
[1-benzothiophen-7-yl-(4-fluorophenyl)methyl]hydrazine
CID 105192643
[(2-chloro-3-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335384
[1-benzothiophen-7-yl-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105327697
[(3-fluoro-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105258625
[(3-chlorothiophen-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335330
[2,3-dihydro-1,4-benzodioxin-5-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335368
[1-benzothiophen-7-yl-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 105201464
[(3-fluoro-4-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105258630

Frequently Asked Questions

What is the IUPAC name of [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine (CID 105258549) is [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine is NNC(c1ccncc1F)c1cccc2ccsc12.
What is the InChIKey of [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is LYZLDUAPCWKWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3S/c15-12-8-17-6-4-10(12)13(18-16)11-3-1-2-9-5-7-19-14(9)11/h1-8,13,18H,16H2.
What are the key properties of [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine?
[1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 273.34 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-7-yl-(3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105258549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).