[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine

C12H16F2N2O — CID 105305016

IUPAC[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine
SMILESCC1CC(C(NN)c2ccc(F)c(F)c2)CO1
InChIInChI=1S/C12H16F2N2O/c1-7-4-9(6-17-7)12(16-15)8-2-3-10(13)11(14)5-8/h2-3,5,7,9,12,16H,4,6,15H2,1H3
InChIKeyZQVPBHIKMSUYCT-UHFFFAOYSA-N
MW242.27 g/mol
LogP1.89
Rot. Bonds3

About [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine

[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine (PubChem CID 105305016) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine
PubChem CID105305016
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine
SMILESCC1CC(C(NN)c2ccc(F)c(F)c2)CO1
InChIInChI=1S/C12H16F2N2O/c1-7-4-9(6-17-7)12(16-15)8-2-3-10(13)11(14)5-8/h2-3,5,7,9,12,16H,4,6,15H2,1H3
InChIKeyZQVPBHIKMSUYCT-UHFFFAOYSA-N
XLogP1.89
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[(3,5-dimethylphenyl)-(5-methyloxolan-3-yl)methyl]hydrazine
CID 105286824
(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826691
[(3,4-difluorophenyl)-(oxan-4-yl)methyl]hydrazine
CID 105197058
[(3-fluoro-4-pyridinyl)-(5-methyloxolan-3-yl)methyl]hydrazine
CID 105335459
[(4-tert-butylcyclohexyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105232707
[(3,4-difluorophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105197240
[(2,5-dimethylphenyl)-(5-methyloxolan-3-yl)methyl]hydrazine
CID 105292630
[(3,4-difluorophenyl)-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
CID 105259573
[7-bicyclo[4.1.0]heptanyl-(3,4-difluorophenyl)methyl]hydrazine
CID 105304990
[4-fluoro-3-(trifluoromethyl)phenyl]-(5-methyloxolan-3-yl)methanamine
CID 107291977
[(5-methyloxolan-3-yl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105320635
[(3,4-difluorophenyl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248107

Frequently Asked Questions

What is the IUPAC name of [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine?
The IUPAC name of [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine (CID 105305016) is [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine is CC1CC(C(NN)c2ccc(F)c(F)c2)CO1.
What is the InChIKey of [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine?
The InChIKey is ZQVPBHIKMSUYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2O/c1-7-4-9(6-17-7)12(16-15)8-2-3-10(13)11(14)5-8/h2-3,5,7,9,12,16H,4,6,15H2,1H3.
What are the key properties of [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine?
[(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine has a molecular weight of 242.27 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105305016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).