[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine

C13H13BrFN3 — CID 105268031

IUPAC[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)ccc1C(NN)c1ncccc1Br
InChIInChI=1S/C13H13BrFN3/c1-8-7-9(15)4-5-10(8)12(18-16)13-11(14)3-2-6-17-13/h2-7,12,18H,16H2,1H3
InChIKeyZSRRODJXPPQQRL-UHFFFAOYSA-N
MW310.17 g/mol
LogP2.84
Rot. Bonds3

About [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine

[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine (PubChem CID 105268031) has the molecular formula C13H13BrFN3 and a molecular weight of 310.17 g/mol. Its IUPAC name is [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
PubChem CID105268031
Molecular FormulaC13H13BrFN3
Molecular Weight310.17 g/mol
Exact Mass309.03
IUPAC Name[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)ccc1C(NN)c1ncccc1Br
InChIInChI=1S/C13H13BrFN3/c1-8-7-9(15)4-5-10(8)12(18-16)13-11(14)3-2-6-17-13/h2-7,12,18H,16H2,1H3
InChIKeyZSRRODJXPPQQRL-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

[(4-fluoro-2-methylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
CID 105257778
(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methanamine
CID 113398464
[(3-bromo-2-pyridinyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105267988
[(4-fluoro-2-methylphenyl)-pyridin-2-ylmethyl]hydrazine
CID 105195807
[(3-bromo-2-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105268115
[(3-bromo-2-pyridinyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107130883
[(4-fluoro-2-methylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105256590
[(2,4-difluorophenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
CID 105257856
3-[(3-bromo-2-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
CID 105268078
1-(3-bromo-2-pyridinyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114348316
[(4-fluoro-2-methylphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
CID 105261808
[(3-bromo-2-pyridinyl)-(3-methylphenyl)methyl]hydrazine
CID 105268060

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine (CID 105268031) is [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine is Cc1cc(F)ccc1C(NN)c1ncccc1Br.
What is the InChIKey of [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine?
The InChIKey is ZSRRODJXPPQQRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrFN3/c1-8-7-9(15)4-5-10(8)12(18-16)13-11(14)3-2-6-17-13/h2-7,12,18H,16H2,1H3.
What are the key properties of [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine?
[(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)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 [(3-bromo-2-pyridinyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105268031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).