[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine

C17H18BrFN2 — CID 105342038

IUPAC[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1cccc(C2CCC2)c1)c1cc(F)ccc1Br
InChIInChI=1S/C17H18BrFN2/c18-16-8-7-14(19)10-15(16)17(21-20)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2
InChIKeyAZTBYYYAFSBCBK-UHFFFAOYSA-N
MW349.25 g/mol
LogP4.41
Rot. Bonds4

About [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine

[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine (PubChem CID 105342038) has the molecular formula C17H18BrFN2 and a molecular weight of 349.25 g/mol. Its IUPAC name is [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
PubChem CID105342038
Molecular FormulaC17H18BrFN2
Molecular Weight349.25 g/mol
Exact Mass348.06
IUPAC Name[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1cccc(C2CCC2)c1)c1cc(F)ccc1Br
InChIInChI=1S/C17H18BrFN2/c18-16-8-7-14(19)10-15(16)17(21-20)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2
InChIKeyAZTBYYYAFSBCBK-UHFFFAOYSA-N
XLogP4.41
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.25
LogP ≤ 54.41
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

[(4-bromo-3-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342018
[(3-bromo-2-methylphenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342034
4-bromo-2-[(3-cyclobutylphenyl)-hydrazinylmethyl]aniline
CID 105263441
[(3-cyclobutylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105342046
[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
CID 105342056
[(2-bromo-5-fluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283657
[(2-chlorofuran-3-yl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 106694793
[(3-cyclobutylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105342013
[(3-cyclobutylphenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279785
[(3-cyclobutylphenyl)-(2,6-dimethyl-3-pyridinyl)methyl]hydrazine
CID 105341962
[(2-bromo-5-fluorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
CID 105300293
(2-bromo-5-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 115836289

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine (CID 105342038) is [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine is NNC(c1cccc(C2CCC2)c1)c1cc(F)ccc1Br.
What is the InChIKey of [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine?
The InChIKey is AZTBYYYAFSBCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrFN2/c18-16-8-7-14(19)10-15(16)17(21-20)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2.
What are the key properties of [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine?
[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine has a molecular weight of 349.25 g/mol, XLogP of 4.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine is sourced from PubChem (CID 105342038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).