[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine

C13H13BrFN3 — CID 105280440

IUPAC[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1ccncc1C(NN)c1c(F)cccc1Br
InChIInChI=1S/C13H13BrFN3/c1-8-5-6-17-7-9(8)13(18-16)12-10(14)3-2-4-11(12)15/h2-7,13,18H,16H2,1H3
InChIKeyODUNVFOVBBOVJF-UHFFFAOYSA-N
MW310.17 g/mol
LogP2.84
Rot. Bonds3

About [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine

[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine (PubChem CID 105280440) has the molecular formula C13H13BrFN3 and a molecular weight of 310.17 g/mol. Its IUPAC name is [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
PubChem CID105280440
Molecular FormulaC13H13BrFN3
Molecular Weight310.17 g/mol
Exact Mass309.03
IUPAC Name[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1ccncc1C(NN)c1c(F)cccc1Br
InChIInChI=1S/C13H13BrFN3/c1-8-5-6-17-7-9(8)13(18-16)12-10(14)3-2-4-11(12)15/h2-7,13,18H,16H2,1H3
InChIKeyODUNVFOVBBOVJF-UHFFFAOYSA-N
XLogP2.84
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.17
LogP ≤ 52.84
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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Related Compounds

1-(2-bromo-6-fluorophenyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 114887123
N-[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 114887468
[(2,3-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279808
[(4-methyl-3-pyridinyl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine
CID 105320555
[(3-fluoro-4-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105258630
[(3-bromo-2-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105268115
3-[(2-bromo-6-fluorophenyl)-(ethylamino)methyl]pyridin-4-amine
CID 114887250
[(3-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105193054
[(2,6-difluorophenyl)-(3-ethyl-4-pyridinyl)methyl]hydrazine
CID 105262104
[(2-bromo-6-fluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105280555
[(3-bromo-4-methylphenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105320516
[(3-bromo-2-fluorophenyl)-(2,6-difluoro-3-methylphenyl)methyl]hydrazine
CID 106649829

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine (CID 105280440) is [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine is Cc1ccncc1C(NN)c1c(F)cccc1Br.
What is the InChIKey of [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine?
The InChIKey is ODUNVFOVBBOVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrFN3/c1-8-5-6-17-7-9(8)13(18-16)12-10(14)3-2-4-11(12)15/h2-7,13,18H,16H2,1H3.
What are the key properties of [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine?
[(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine has a molecular weight of 310.17 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-6-fluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105280440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).