1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine

C17H21FN2O — CID 169385064

IUPAC1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCC(C)OCc1cc(F)ccc1CNNc1ccccc1
InChIInChI=1S/C17H21FN2O/c1-13(2)21-12-15-10-16(18)9-8-14(15)11-19-20-17-6-4-3-5-7-17/h3-10,13,19-20H,11-12H2,1-2H3
InChIKeyXWPZTDUEPKHTIJ-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.87
Rot. Bonds7

About 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine

1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine (PubChem CID 169385064) has the molecular formula C17H21FN2O and a molecular weight of 288.37 g/mol. Its IUPAC name is 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine
PubChem CID169385064
Molecular FormulaC17H21FN2O
Molecular Weight288.37 g/mol
Exact Mass288.16
IUPAC Name1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCC(C)OCc1cc(F)ccc1CNNc1ccccc1
InChIInChI=1S/C17H21FN2O/c1-13(2)21-12-15-10-16(18)9-8-14(15)11-19-20-17-6-4-3-5-7-17/h3-10,13,19-20H,11-12H2,1-2H3
InChIKeyXWPZTDUEPKHTIJ-UHFFFAOYSA-N
XLogP3.87
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[[4-fluoro-2-(propoxymethyl)phenyl]methyl]-2-phenylhydrazine
CID 169385047
1-[(5-fluoro-2-methylphenyl)methyl]-2-phenylhydrazine
CID 169384413
1,4-difluoro-2-(propan-2-yloxymethyl)benzene
CID 58479340
1-[[4-fluoro-2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylhydrazine
CID 169385039
1-[[2-[(3-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
CID 169385379
1-[(2-ethoxy-3,5-difluorophenyl)methyl]-2-phenylhydrazine
CID 169385910
1-[[5-chloro-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
CID 169385645
1-[(2-bromo-3,5-difluorophenyl)methyl]-2-phenylhydrazine
CID 169384645
2-[5-fluoro-2-(propan-2-yloxymethyl)phenyl]acetaldehyde
CID 83885042
1-[[4-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
CID 169385678
1-[(2,4-dimethoxyphenyl)methyl]-2-phenylhydrazine
CID 169384267
1-[[2-(4-fluorophenoxy)phenyl]methyl]-2-phenylhydrazine
CID 169385090

Frequently Asked Questions

What is the IUPAC name of 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine (CID 169385064) is 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine is CC(C)OCc1cc(F)ccc1CNNc1ccccc1.
What is the InChIKey of 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine?
The InChIKey is XWPZTDUEPKHTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O/c1-13(2)21-12-15-10-16(18)9-8-14(15)11-19-20-17-6-4-3-5-7-17/h3-10,13,19-20H,11-12H2,1-2H3.
What are the key properties of 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine?
1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine has a molecular weight of 288.37 g/mol, XLogP of 3.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-fluoro-2-(propan-2-yloxymethyl)phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169385064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).