[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine

C14H14BrFN2 — CID 105285496

IUPAC[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine
SMILESCc1cc(Br)cc(C(NN)c2cccc(F)c2)c1
InChIInChI=1S/C14H14BrFN2/c1-9-5-11(7-12(15)6-9)14(18-17)10-3-2-4-13(16)8-10/h2-8,14,18H,17H2,1H3
InChIKeyKVNXGBRHHGCITD-UHFFFAOYSA-N
MW309.18 g/mol
LogP3.45
Rot. Bonds3

About [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine

[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine (PubChem CID 105285496) has the molecular formula C14H14BrFN2 and a molecular weight of 309.18 g/mol. Its IUPAC name is [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine
PubChem CID105285496
Molecular FormulaC14H14BrFN2
Molecular Weight309.18 g/mol
Exact Mass308.03
IUPAC Name[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine
SMILESCc1cc(Br)cc(C(NN)c2cccc(F)c2)c1
InChIInChI=1S/C14H14BrFN2/c1-9-5-11(7-12(15)6-9)14(18-17)10-3-2-4-13(16)8-10/h2-8,14,18H,17H2,1H3
InChIKeyKVNXGBRHHGCITD-UHFFFAOYSA-N
XLogP3.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.18
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

[(3-bromo-5-fluorophenyl)-(3-methylphenyl)methyl]hydrazine
CID 105238627
[(3-bromo-5-methylphenyl)-(3-methylphenyl)methyl]hydrazine
CID 105284831
[(4-bromo-3,5-dimethylphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105279509
[(3-fluorophenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
CID 105285550
[(3-bromo-5-chlorophenyl)-(3-methylphenyl)methyl]hydrazine
CID 107948017
[(3-bromo-5-methylphenyl)-naphthalen-2-ylmethyl]hydrazine
CID 105301492
[(3,4-dimethylphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105193094
[(2-bromo-6-fluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105280555
[(4-bromo-3,5-dimethylphenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105279605
[(3-bromo-5-methylphenyl)-(2,6-difluoro-3-methylphenyl)methyl]hydrazine
CID 105330192
[(3-bromophenyl)-phenylmethyl]hydrazine;toluene
CID 145340626
[(3-bromo-5-methylphenyl)-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
CID 106884654

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine (CID 105285496) is [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine is Cc1cc(Br)cc(C(NN)c2cccc(F)c2)c1.
What is the InChIKey of [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine?
The InChIKey is KVNXGBRHHGCITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrFN2/c1-9-5-11(7-12(15)6-9)14(18-17)10-3-2-4-13(16)8-10/h2-8,14,18H,17H2,1H3.
What are the key properties of [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine?
[(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine has a molecular weight of 309.18 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-5-methylphenyl)-(3-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105285496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).