[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

C14H11F2N3O — CID 105258723

IUPAC[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1cc2cccc(F)c2o1)c1ccncc1F
InChIInChI=1S/C14H11F2N3O/c15-10-3-1-2-8-6-12(20-14(8)10)13(19-17)9-4-5-18-7-11(9)16/h1-7,13,19H,17H2
InChIKeyPIKSBMYUUBCRKB-UHFFFAOYSA-N
MW275.26 g/mol
LogP2.66
Rot. Bonds3

About [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 105258723) has the molecular formula C14H11F2N3O and a molecular weight of 275.26 g/mol. Its IUPAC name is [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
PubChem CID105258723
Molecular FormulaC14H11F2N3O
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Name[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1cc2cccc(F)c2o1)c1ccncc1F
InChIInChI=1S/C14H11F2N3O/c15-10-3-1-2-8-6-12(20-14(8)10)13(19-17)9-4-5-18-7-11(9)16/h1-7,13,19H,17H2
InChIKeyPIKSBMYUUBCRKB-UHFFFAOYSA-N
XLogP2.66
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.26
LogP ≤ 52.66
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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Frequently Asked Questions

What is the IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (CID 105258723) is [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is NNC(c1cc2cccc(F)c2o1)c1ccncc1F.
What is the InChIKey of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is PIKSBMYUUBCRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3O/c15-10-3-1-2-8-6-12(20-14(8)10)13(19-17)9-4-5-18-7-11(9)16/h1-7,13,19H,17H2.
What are the key properties of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 275.26 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105258723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).