[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

C12H10ClF2N3 — CID 105397937

IUPAC[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccncc1F)c1cc(F)ccc1Cl
InChIInChI=1S/C12H10ClF2N3/c13-10-2-1-7(14)5-9(10)12(18-16)8-3-4-17-6-11(8)15/h1-6,12,18H,16H2
InChIKeyHMWYFORFANBWTI-UHFFFAOYSA-N
MW269.68 g/mol
LogP2.57
Rot. Bonds3

About [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 105397937) has the molecular formula C12H10ClF2N3 and a molecular weight of 269.68 g/mol. Its IUPAC name is [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
PubChem CID105397937
Molecular FormulaC12H10ClF2N3
Molecular Weight269.68 g/mol
Exact Mass269.05
IUPAC Name[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESNNC(c1ccncc1F)c1cc(F)ccc1Cl
InChIInChI=1S/C12H10ClF2N3/c13-10-2-1-7(14)5-9(10)12(18-16)8-3-4-17-6-11(8)15/h1-6,12,18H,16H2
InChIKeyHMWYFORFANBWTI-UHFFFAOYSA-N
XLogP2.57
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.68
LogP ≤ 52.57
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-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (CID 105397937) is [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is NNC(c1ccncc1F)c1cc(F)ccc1Cl.
What is the InChIKey of [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is HMWYFORFANBWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClF2N3/c13-10-2-1-7(14)5-9(10)12(18-16)8-3-4-17-6-11(8)15/h1-6,12,18H,16H2.
What are the key properties of [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 269.68 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105397937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).