[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine

C12H11F2N3 — CID 105196453

IUPAC[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine
SMILESNNC(c1ccncc1)c1cccc(F)c1F
InChIInChI=1S/C12H11F2N3/c13-10-3-1-2-9(11(10)14)12(17-15)8-4-6-16-7-5-8/h1-7,12,17H,15H2
InChIKeyBHVZXWCUDOPSTF-UHFFFAOYSA-N
MW235.24 g/mol
LogP1.91
Rot. Bonds3

About [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine

[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine (PubChem CID 105196453) has the molecular formula C12H11F2N3 and a molecular weight of 235.24 g/mol. Its IUPAC name is [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine
PubChem CID105196453
Molecular FormulaC12H11F2N3
Molecular Weight235.24 g/mol
Exact Mass235.09
IUPAC Name[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine
SMILESNNC(c1ccncc1)c1cccc(F)c1F
InChIInChI=1S/C12H11F2N3/c13-10-3-1-2-9(11(10)14)12(17-15)8-4-6-16-7-5-8/h1-7,12,17H,15H2
InChIKeyBHVZXWCUDOPSTF-UHFFFAOYSA-N
XLogP1.91
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 51.91
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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Frequently Asked Questions

What is the IUPAC name of [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine?
The IUPAC name of [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine (CID 105196453) is [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine.
What is the SMILES notation for [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine?
The canonical SMILES for [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine is NNC(c1ccncc1)c1cccc(F)c1F.
What is the InChIKey of [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine?
The InChIKey is BHVZXWCUDOPSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2N3/c13-10-3-1-2-9(11(10)14)12(17-15)8-4-6-16-7-5-8/h1-7,12,17H,15H2.
What are the key properties of [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine?
[(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine has a molecular weight of 235.24 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,3-difluorophenyl)-pyridin-4-ylmethyl]hydrazine is sourced from PubChem (CID 105196453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).