[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine

C15H14FN3O — CID 105257714

IUPAC[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
SMILESCc1ccc2oc(C(NN)c3ncccc3F)cc2c1
InChIInChI=1S/C15H14FN3O/c1-9-4-5-12-10(7-9)8-13(20-12)15(19-17)14-11(16)3-2-6-18-14/h2-8,15,19H,17H2,1H3
InChIKeySNIORYKECQTQNJ-UHFFFAOYSA-N
MW271.30 g/mol
LogP2.83
Rot. Bonds3

About [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine

[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine (PubChem CID 105257714) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
PubChem CID105257714
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
SMILESCc1ccc2oc(C(NN)c3ncccc3F)cc2c1
InChIInChI=1S/C15H14FN3O/c1-9-4-5-12-10(7-9)8-13(20-12)15(19-17)14-11(16)3-2-6-18-14/h2-8,15,19H,17H2,1H3
InChIKeySNIORYKECQTQNJ-UHFFFAOYSA-N
XLogP2.83
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 52.83
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 [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine (CID 105257714) is [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine is Cc1ccc2oc(C(NN)c3ncccc3F)cc2c1.
What is the InChIKey of [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The InChIKey is SNIORYKECQTQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c1-9-4-5-12-10(7-9)8-13(20-12)15(19-17)14-11(16)3-2-6-18-14/h2-8,15,19H,17H2,1H3.
What are the key properties of [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
[(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine has a molecular weight of 271.30 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-2-pyridinyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105257714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).