1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

C15H14F4N2 — CID 169385923

IUPAC1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCc1cc(CNNc2ccccc2)cc(C(F)(F)F)c1F
InChIInChI=1S/C15H14F4N2/c1-10-7-11(8-13(14(10)16)15(17,18)19)9-20-21-12-5-3-2-4-6-12/h2-8,20-21H,9H2,1H3
InChIKeyWEHQLWGQKIIXPH-UHFFFAOYSA-N
MW298.28 g/mol
LogP4.27
Rot. Bonds4

About 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (PubChem CID 169385923) has the molecular formula C15H14F4N2 and a molecular weight of 298.28 g/mol. Its IUPAC name is 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
PubChem CID169385923
Molecular FormulaC15H14F4N2
Molecular Weight298.28 g/mol
Exact Mass298.11
IUPAC Name1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCc1cc(CNNc2ccccc2)cc(C(F)(F)F)c1F
InChIInChI=1S/C15H14F4N2/c1-10-7-11(8-13(14(10)16)15(17,18)19)9-20-21-12-5-3-2-4-6-12/h2-8,20-21H,9H2,1H3
InChIKeyWEHQLWGQKIIXPH-UHFFFAOYSA-N
XLogP4.27
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169387097
1-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]phenyl]methyl]-2-phenylhydrazine
CID 169385350
[2-methyl-4-[(2-phenylhydrazinyl)methyl]phenyl]boronic acid
CID 169384701
1-[[2-chloro-6-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169384542
1-[(5-fluoro-2-methylphenyl)methyl]-2-phenylhydrazine
CID 169384413
1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169386753
1-[(3,5-difluoro-4-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384890
2,2-difluoro-N-[(4-fluoro-3,5-dimethylphenyl)methyl]-2-phenylethanamine
CID 116789196
1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169384474
1-[(2-chloro-4-fluoro-5-methylphenyl)methyl]-2-phenylhydrazine
CID 169386722
1-[(3,4-difluoro-5-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384801
1-[(2,4-dimethylphenyl)methyl]-2-phenylhydrazine
CID 169384445

Frequently Asked Questions

What is the IUPAC name of 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (CID 169385923) is 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is Cc1cc(CNNc2ccccc2)cc(C(F)(F)F)c1F.
What is the InChIKey of 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The InChIKey is WEHQLWGQKIIXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F4N2/c1-10-7-11(8-13(14(10)16)15(17,18)19)9-20-21-12-5-3-2-4-6-12/h2-8,20-21H,9H2,1H3.
What are the key properties of 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine has a molecular weight of 298.28 g/mol, XLogP of 4.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169385923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).