[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine

C12H19FN2 — CID 105282720

IUPAC[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine
SMILESCc1ccc(C(CC(C)C)NN)c(F)c1
InChIInChI=1S/C12H19FN2/c1-8(2)6-12(15-14)10-5-4-9(3)7-11(10)13/h4-5,7-8,12,15H,6,14H2,1-3H3
InChIKeyXNWWUGQGOAPSDE-UHFFFAOYSA-N
MW210.30 g/mol
LogP2.68
Rot. Bonds4

About [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine

[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine (PubChem CID 105282720) has the molecular formula C12H19FN2 and a molecular weight of 210.30 g/mol. Its IUPAC name is [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine
PubChem CID105282720
Molecular FormulaC12H19FN2
Molecular Weight210.30 g/mol
Exact Mass210.15
IUPAC Name[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine
SMILESCc1ccc(C(CC(C)C)NN)c(F)c1
InChIInChI=1S/C12H19FN2/c1-8(2)6-12(15-14)10-5-4-9(3)7-11(10)13/h4-5,7-8,12,15H,6,14H2,1-3H3
InChIKeyXNWWUGQGOAPSDE-UHFFFAOYSA-N
XLogP2.68
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 52.68
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

[1-(2-fluoro-4-methylphenyl)-2-methoxyethyl]hydrazine
CID 105321602
[1-(2-fluorophenyl)-3-methylbutyl]hydrazine
CID 105198906
[2-(2,6-difluorophenyl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105342843
1-(2-fluoro-4-methylphenyl)hexylhydrazine
CID 105294599
[2-cyclopropyl-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105311039
[1-(2-fluoro-4-methylphenyl)-4-phenylbutyl]hydrazine
CID 105299781
[2-(3-bromo-5-fluorophenyl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105324778
[2-(3-bromothiophen-2-yl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105299497
1-(2-fluoro-4-methylphenyl)-4-methylpentan-1-amine
CID 112631075
[1-(4-chloro-2-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868423
[1-(2-fluoro-5-methylphenyl)-2-(2-methylpropylsulfanyl)ethyl]hydrazine
CID 105226703
1-(2-fluoro-4-methylphenyl)-N,3-dimethylhexan-1-amine
CID 115845233

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine?
The IUPAC name of [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine (CID 105282720) is [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine is Cc1ccc(C(CC(C)C)NN)c(F)c1.
What is the InChIKey of [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine?
The InChIKey is XNWWUGQGOAPSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN2/c1-8(2)6-12(15-14)10-5-4-9(3)7-11(10)13/h4-5,7-8,12,15H,6,14H2,1-3H3.
What are the key properties of [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine?
[1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine has a molecular weight of 210.30 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-4-methylphenyl)-3-methylbutyl]hydrazine is sourced from PubChem (CID 105282720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).