[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine

C13H19FN2O2 — CID 103397793

IUPAC[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCC(C)O2)c(F)c1
InChIInChI=1S/C13H19FN2O2/c1-8-3-6-12(18-8)13(16-15)10-5-4-9(17-2)7-11(10)14/h4-5,7-8,12-13,16H,3,6,15H2,1-2H3
InChIKeyYADHPUZJQGJVOJ-UHFFFAOYSA-N
MW254.31 g/mol
LogP1.91
Rot. Bonds4

About [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine

[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine (PubChem CID 103397793) has the molecular formula C13H19FN2O2 and a molecular weight of 254.31 g/mol. Its IUPAC name is [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
PubChem CID103397793
Molecular FormulaC13H19FN2O2
Molecular Weight254.31 g/mol
Exact Mass254.14
IUPAC Name[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCC(C)O2)c(F)c1
InChIInChI=1S/C13H19FN2O2/c1-8-3-6-12(18-8)13(16-15)10-5-4-9(17-2)7-11(10)14/h4-5,7-8,12-13,16H,3,6,15H2,1-2H3
InChIKeyYADHPUZJQGJVOJ-UHFFFAOYSA-N
XLogP1.91
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(2,3-difluoro-4-methylphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 107516568
N-[(4-methoxy-2-methylphenyl)-(5-methyloxolan-2-yl)methyl]ethanamine
CID 81330427
[(3,4-dimethoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105301173
2-[chloro-(2-chloro-4-methoxyphenyl)methyl]-5-methyloxolane
CID 81326929
[2-cyclopropyl-1-(2-fluoro-4-methoxyphenyl)propyl]hydrazine
CID 103397832
(2-fluoro-4,5-dimethoxyphenyl)-(5-methyloxolan-2-yl)methanamine
CID 81331181
1-(2-fluoro-4-methoxyphenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 103395598
1-(4-bromo-2,5-difluorophenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 81331183
N-[cyclopentyl-(2-fluoro-4-methoxyphenyl)methyl]propan-1-amine
CID 43561568
N-[(2-fluoro-4-methoxyphenyl)-(2-methylcyclopropyl)methyl]ethanamine
CID 43561496
[(5-fluoro-3-pyridinyl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105288195
[(3-methoxypyrazin-2-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105332713

Frequently Asked Questions

What is the IUPAC name of [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine?
The IUPAC name of [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine (CID 103397793) is [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine?
The canonical SMILES for [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine is COc1ccc(C(NN)C2CCC(C)O2)c(F)c1.
What is the InChIKey of [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine?
The InChIKey is YADHPUZJQGJVOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O2/c1-8-3-6-12(18-8)13(16-15)10-5-4-9(17-2)7-11(10)14/h4-5,7-8,12-13,16H,3,6,15H2,1-2H3.
What are the key properties of [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine?
[(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine has a molecular weight of 254.31 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-fluoro-4-methoxyphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine is sourced from PubChem (CID 103397793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).