[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine

C15H25FN2O2 — CID 105273616

IUPAC[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
SMILESCOc1cccc(CC(NN)C(OC)C(C)(C)C)c1F
InChIInChI=1S/C15H25FN2O2/c1-15(2,3)14(20-5)11(18-17)9-10-7-6-8-12(19-4)13(10)16/h6-8,11,14,18H,9,17H2,1-5H3
InChIKeyQLLHBWLMEJSWOO-UHFFFAOYSA-N
MW284.38 g/mol
LogP2.27
Rot. Bonds6

About [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine

[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine (PubChem CID 105273616) has the molecular formula C15H25FN2O2 and a molecular weight of 284.38 g/mol. Its IUPAC name is [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
PubChem CID105273616
Molecular FormulaC15H25FN2O2
Molecular Weight284.38 g/mol
Exact Mass284.19
IUPAC Name[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
SMILESCOc1cccc(CC(NN)C(OC)C(C)(C)C)c1F
InChIInChI=1S/C15H25FN2O2/c1-15(2,3)14(20-5)11(18-17)9-10-7-6-8-12(19-4)13(10)16/h6-8,11,14,18H,9,17H2,1-5H3
InChIKeyQLLHBWLMEJSWOO-UHFFFAOYSA-N
XLogP2.27
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.27
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

[1-(2,3-difluorophenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
CID 105273557
[1-(2-fluoro-3-methoxyphenyl)-3-methylpentan-2-yl]hydrazine
CID 105219814
3-ethoxy-1-(2-fluoro-3-methoxyphenyl)-N,4,4-trimethylpentan-2-amine
CID 116725535
1-(2-fluoro-3-methoxyphenyl)-N,3,4-trimethylpentan-2-amine
CID 105035513
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4,4-dimethylpentan-2-amine
CID 116724723
[1-(3,5-difluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105207998
2-[(2-fluoro-3-methoxyphenyl)methyl]-3,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 104794746
[1-cyclooctyl-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105255263
4-(2-fluoro-3-methoxyphenyl)-3-methylbutan-2-amine
CID 104792644
[3-ethoxy-1-(2-fluorophenyl)-4,4-dimethylpentan-2-yl]hydrazine
CID 105273741
[1-(2-chlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105211219
[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylcyclohexyl)ethyl]hydrazine
CID 105210747

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine (CID 105273616) is [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine is COc1cccc(CC(NN)C(OC)C(C)(C)C)c1F.
What is the InChIKey of [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The InChIKey is QLLHBWLMEJSWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FN2O2/c1-15(2,3)14(20-5)11(18-17)9-10-7-6-8-12(19-4)13(10)16/h6-8,11,14,18H,9,17H2,1-5H3.
What are the key properties of [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
[1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine has a molecular weight of 284.38 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-3-methoxyphenyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine is sourced from PubChem (CID 105273616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).