[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine

C13H18F2N2 — CID 105310002

IUPAC[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(CC2CCC2)NN)c1F
InChIInChI=1S/C13H18F2N2/c1-8-5-6-10(14)12(13(8)15)11(17-16)7-9-3-2-4-9/h5-6,9,11,17H,2-4,7,16H2,1H3
InChIKeyIWVDNYFYSWCRTQ-UHFFFAOYSA-N
MW240.30 g/mol
LogP2.97
Rot. Bonds4

About [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine

[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine (PubChem CID 105310002) has the molecular formula C13H18F2N2 and a molecular weight of 240.30 g/mol. Its IUPAC name is [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
PubChem CID105310002
Molecular FormulaC13H18F2N2
Molecular Weight240.30 g/mol
Exact Mass240.14
IUPAC Name[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(CC2CCC2)NN)c1F
InChIInChI=1S/C13H18F2N2/c1-8-5-6-10(14)12(13(8)15)11(17-16)7-9-3-2-4-9/h5-6,9,11,17H,2-4,7,16H2,1H3
InChIKeyIWVDNYFYSWCRTQ-UHFFFAOYSA-N
XLogP2.97
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 52.97
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-(3-bromo-2,6-difluorophenyl)-2-cyclobutylethyl]hydrazine
CID 106945539
2-cyclopropyl-1-(2,6-difluoro-3-methylphenyl)-N-ethylethanamine
CID 82823061
[2-cycloheptyl-1-(2,6-difluorophenyl)ethyl]hydrazine
CID 105308040
[2-cyclobutyl-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105310166
[2-cyclobutyl-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309984
1-(3-bromo-2,6-difluorophenyl)-2-cyclobutyl-N-methylethanamine
CID 106944871
1-(2,6-difluoro-3-methylphenyl)-N-ethyl-2-(oxan-4-yl)ethanamine
CID 115846782
[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
CID 105299069
3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259156
[2-cyclohexyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
CID 105296186
1-(2,6-difluoro-3-methylphenyl)hexylhydrazine
CID 105294572
[(2,6-difluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232448

Frequently Asked Questions

What is the IUPAC name of [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine (CID 105310002) is [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine is Cc1ccc(F)c(C(CC2CCC2)NN)c1F.
What is the InChIKey of [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The InChIKey is IWVDNYFYSWCRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F2N2/c1-8-5-6-10(14)12(13(8)15)11(17-16)7-9-3-2-4-9/h5-6,9,11,17H,2-4,7,16H2,1H3.
What are the key properties of [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine has a molecular weight of 240.30 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105310002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).