[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine

C12H18F2N2 — CID 105303401

IUPAC[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine
SMILESCC(C)C(C)C(NN)c1cc(F)ccc1F
InChIInChI=1S/C12H18F2N2/c1-7(2)8(3)12(16-15)10-6-9(13)4-5-11(10)14/h4-8,12,16H,15H2,1-3H3
InChIKeyLYNHCGVEMKYQSR-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.76
Rot. Bonds4

About [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine

[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine (PubChem CID 105303401) has the molecular formula C12H18F2N2 and a molecular weight of 228.29 g/mol. Its IUPAC name is [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine
PubChem CID105303401
Molecular FormulaC12H18F2N2
Molecular Weight228.29 g/mol
Exact Mass228.14
IUPAC Name[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine
SMILESCC(C)C(C)C(NN)c1cc(F)ccc1F
InChIInChI=1S/C12H18F2N2/c1-7(2)8(3)12(16-15)10-6-9(13)4-5-11(10)14/h4-8,12,16H,15H2,1-3H3
InChIKeyLYNHCGVEMKYQSR-UHFFFAOYSA-N
XLogP2.76
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.76
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-(2,5-difluorophenyl)ethylhydrazine
CID 53402215
[1-(2-bromo-5-fluorophenyl)-2-methylpropyl]hydrazine
CID 105281765
[1-(3-fluorophenyl)-2,3-dimethylbutyl]hydrazine
CID 105285597
1-(2,5-difluorophenyl)-1-hydrazinyl-N-methylmethanamine
CID 116961736
[1-[5-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropyl]hydrazine
CID 105257619
(1S)-1-(2,5-difluorophenyl)ethanamine;hydrochloride
CID 53484729
[1-(2-bromo-4-fluorophenyl)-2-methylpropyl]hydrazine
CID 105281686
4-fluoro-2-(1-hydrazinylethyl)phenol
CID 53402356
[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105280098
[(2,5-difluorophenyl)-(4-fluorophenyl)methyl]hydrazine
CID 105192702
[1-(2,4-difluorophenyl)-2-methoxy-3-methylbutyl]hydrazine
CID 105272113
2-(1-chloroethyl)-1,4-difluorobenzene
CID 43114942

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine?
The IUPAC name of [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine (CID 105303401) is [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine.
What is the SMILES notation for [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine?
The canonical SMILES for [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine is CC(C)C(C)C(NN)c1cc(F)ccc1F.
What is the InChIKey of [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine?
The InChIKey is LYNHCGVEMKYQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18F2N2/c1-7(2)8(3)12(16-15)10-6-9(13)4-5-11(10)14/h4-8,12,16H,15H2,1-3H3.
What are the key properties of [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine?
[1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine has a molecular weight of 228.29 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-difluorophenyl)-2,3-dimethylbutyl]hydrazine is sourced from PubChem (CID 105303401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).