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

C17H18BrFN2 — CID 105280506

IUPAC[(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccc(C2CCC2)cc1)c1c(F)cccc1Br
InChIInChI=1S/C17H18BrFN2/c18-14-5-2-6-15(19)16(14)17(21-20)13-9-7-12(8-10-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2
InChIKeyQLPDHAYISDUVJH-UHFFFAOYSA-N
MW349.25 g/mol
LogP4.41
Rot. Bonds4

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

[(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine (PubChem CID 105280506) has the molecular formula C17H18BrFN2 and a molecular weight of 349.25 g/mol. Its IUPAC name is [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine
PubChem CID105280506
Molecular FormulaC17H18BrFN2
Molecular Weight349.25 g/mol
Exact Mass348.06
IUPAC Name[(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccc(C2CCC2)cc1)c1c(F)cccc1Br
InChIInChI=1S/C17H18BrFN2/c18-14-5-2-6-15(19)16(14)17(21-20)13-9-7-12(8-10-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2
InChIKeyQLPDHAYISDUVJH-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-cyclobutylphenyl)-(2,6-difluorophenyl)methyl]hydrazine
CID 105246723
[(4-cyclobutylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
CID 105257937
[(4-bromo-3-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342018
(2-bromo-3-fluorophenyl)-(4-cyclobutylphenyl)methanamine
CID 105045054
[(2-bromo-6-fluorophenyl)-thiophen-3-ylmethyl]hydrazine
CID 105280312
1-(4-bromo-3-fluorophenyl)-1-(4-cyclobutylphenyl)-N-methylmethanamine
CID 105044859
[(2-bromo-6-fluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105280555
[(4-cyclobutylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105338213
[(4-cyclobutylphenyl)-(3,5-dichlorophenyl)methyl]hydrazine
CID 105338167
[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342038
[(2-bromo-6-fluorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105280541
[(2-bromo-6-fluorophenyl)-(3-bromothiophen-2-yl)methyl]hydrazine
CID 105280536

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine (CID 105280506) is [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine is NNC(c1ccc(C2CCC2)cc1)c1c(F)cccc1Br.
What is the InChIKey of [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine?
The InChIKey is QLPDHAYISDUVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrFN2/c18-14-5-2-6-15(19)16(14)17(21-20)13-9-7-12(8-10-13)11-3-1-4-11/h2,5-11,17,21H,1,3-4,20H2.
What are the key properties of [(2-bromo-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine?
[(2-bromo-6-fluorophenyl)-(4-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-6-fluorophenyl)-(4-cyclobutylphenyl)methyl]hydrazine is sourced from PubChem (CID 105280506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).