1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine

C22H23FN2O — CID 146633032

IUPAC1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine
SMILESCc1ccc(OCc2c(C)cccc2N(C)N)cc1-c1ccc(F)cc1
InChIInChI=1S/C22H23FN2O/c1-15-5-4-6-22(25(3)24)21(15)14-26-19-12-7-16(2)20(13-19)17-8-10-18(23)11-9-17/h4-13H,14,24H2,1-3H3
InChIKeyRRXTUIHLAXOSRP-UHFFFAOYSA-N
MW350.44 g/mol
LogP5.00
Rot. Bonds5

About 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine

1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine (PubChem CID 146633032) has the molecular formula C22H23FN2O and a molecular weight of 350.44 g/mol. Its IUPAC name is 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine
PubChem CID146633032
Molecular FormulaC22H23FN2O
Molecular Weight350.44 g/mol
Exact Mass350.18
IUPAC Name1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine
SMILESCc1ccc(OCc2c(C)cccc2N(C)N)cc1-c1ccc(F)cc1
InChIInChI=1S/C22H23FN2O/c1-15-5-4-6-22(25(3)24)21(15)14-26-19-12-7-16(2)20(13-19)17-8-10-18(23)11-9-17/h4-13H,14,24H2,1-3H3
InChIKeyRRXTUIHLAXOSRP-UHFFFAOYSA-N
XLogP5.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine?
The IUPAC name of 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine (CID 146633032) is 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine.
What is the SMILES notation for 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine?
The canonical SMILES for 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine is Cc1ccc(OCc2c(C)cccc2N(C)N)cc1-c1ccc(F)cc1.
What is the InChIKey of 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine?
The InChIKey is RRXTUIHLAXOSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN2O/c1-15-5-4-6-22(25(3)24)21(15)14-26-19-12-7-16(2)20(13-19)17-8-10-18(23)11-9-17/h4-13H,14,24H2,1-3H3.
What are the key properties of 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine?
1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine has a molecular weight of 350.44 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[3-(4-fluorophenyl)-4-methylphenoxy]methyl]-3-methylphenyl]-1-methylhydrazine is sourced from PubChem (CID 146633032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).