[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine

C17H21FN2O — CID 105329271

IUPAC[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine
SMILESCOc1cccc(C(CCc2ccc(C)cc2)NN)c1F
InChIInChI=1S/C17H21FN2O/c1-12-6-8-13(9-7-12)10-11-15(20-19)14-4-3-5-16(21-2)17(14)18/h3-9,15,20H,10-11,19H2,1-2H3
InChIKeyYWGWDDJCFDOQCF-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.28
Rot. Bonds6

About [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine

[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine (PubChem CID 105329271) has the molecular formula C17H21FN2O and a molecular weight of 288.37 g/mol. Its IUPAC name is [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine
PubChem CID105329271
Molecular FormulaC17H21FN2O
Molecular Weight288.37 g/mol
Exact Mass288.16
IUPAC Name[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine
SMILESCOc1cccc(C(CCc2ccc(C)cc2)NN)c1F
InChIInChI=1S/C17H21FN2O/c1-12-6-8-13(9-7-12)10-11-15(20-19)14-4-3-5-16(21-2)17(14)18/h3-9,15,20H,10-11,19H2,1-2H3
InChIKeyYWGWDDJCFDOQCF-UHFFFAOYSA-N
XLogP3.28
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-difluoro-4-methylphenyl)-3-(4-methylphenyl)propyl]hydrazine
CID 107516737
[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine
CID 105398187
[1-(2-fluoro-5-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105302706
[1-(2-fluoro-3-methoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105205201
1-(2-fluoro-3-methoxyphenyl)-3-(3-methylphenyl)propan-1-ol
CID 105121012
[2-cycloheptyl-1-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105329278
[2-(2-fluoro-3-methoxyphenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105334210
[1-(2,3-difluoro-4-methylphenyl)-3-phenylpropyl]hydrazine
CID 107516336
[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
CID 105329262
[1-(2,5-difluorophenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105219321
N-ethyl-1-(2-fluoro-3-methoxyphenyl)butan-1-amine
CID 82807914
1-(2-fluoro-3-methoxyphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 82807584

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine?
The IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine (CID 105329271) is [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine is COc1cccc(C(CCc2ccc(C)cc2)NN)c1F.
What is the InChIKey of [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine?
The InChIKey is YWGWDDJCFDOQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O/c1-12-6-8-13(9-7-12)10-11-15(20-19)14-4-3-5-16(21-2)17(14)18/h3-9,15,20H,10-11,19H2,1-2H3.
What are the key properties of [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine?
[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine has a molecular weight of 288.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine is sourced from PubChem (CID 105329271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).