1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine

C20H18ClFN2O — CID 169385373

IUPAC1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
SMILESFc1ccc(COc2ccc(Cl)cc2CNNc2ccccc2)cc1
InChIInChI=1S/C20H18ClFN2O/c21-17-8-11-20(25-14-15-6-9-18(22)10-7-15)16(12-17)13-23-24-19-4-2-1-3-5-19/h1-12,23-24H,13-14H2
InChIKeyOYVVSHDEUIPGSZ-UHFFFAOYSA-N
MW356.83 g/mol
LogP5.17
Rot. Bonds7

About 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine

1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine (PubChem CID 169385373) has the molecular formula C20H18ClFN2O and a molecular weight of 356.83 g/mol. Its IUPAC name is 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
PubChem CID169385373
Molecular FormulaC20H18ClFN2O
Molecular Weight356.83 g/mol
Exact Mass356.11
IUPAC Name1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine
SMILESFc1ccc(COc2ccc(Cl)cc2CNNc2ccccc2)cc1
InChIInChI=1S/C20H18ClFN2O/c21-17-8-11-20(25-14-15-6-9-18(22)10-7-15)16(12-17)13-23-24-19-4-2-1-3-5-19/h1-12,23-24H,13-14H2
InChIKeyOYVVSHDEUIPGSZ-UHFFFAOYSA-N
XLogP5.17
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.83
LogP ≤ 55.17
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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Frequently Asked Questions

What is the IUPAC name of 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine (CID 169385373) is 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine is Fc1ccc(COc2ccc(Cl)cc2CNNc2ccccc2)cc1.
What is the InChIKey of 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine?
The InChIKey is OYVVSHDEUIPGSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClFN2O/c21-17-8-11-20(25-14-15-6-9-18(22)10-7-15)16(12-17)13-23-24-19-4-2-1-3-5-19/h1-12,23-24H,13-14H2.
What are the key properties of 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine?
1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine has a molecular weight of 356.83 g/mol, XLogP of 5.17, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169385373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).