1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

C14H12F3IN2 — CID 169386753

IUPAC1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESFC(F)(F)c1cc(I)ccc1CNNc1ccccc1
InChIInChI=1S/C14H12F3IN2/c15-14(16,17)13-8-11(18)7-6-10(13)9-19-20-12-4-2-1-3-5-12/h1-8,19-20H,9H2
InChIKeyAHINEQWCOLWADL-UHFFFAOYSA-N
MW392.16 g/mol
LogP4.43
Rot. Bonds4

About 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (PubChem CID 169386753) has the molecular formula C14H12F3IN2 and a molecular weight of 392.16 g/mol. Its IUPAC name is 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
PubChem CID169386753
Molecular FormulaC14H12F3IN2
Molecular Weight392.16 g/mol
Exact Mass392.00
IUPAC Name1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESFC(F)(F)c1cc(I)ccc1CNNc1ccccc1
InChIInChI=1S/C14H12F3IN2/c15-14(16,17)13-8-11(18)7-6-10(13)9-19-20-12-4-2-1-3-5-12/h1-8,19-20H,9H2
InChIKeyAHINEQWCOLWADL-UHFFFAOYSA-N
XLogP4.43
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.16
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-chloro-4-iodophenyl)methyl]-2-phenylhydrazine
CID 169386761
1-[[2-(1,1,2,2,2-pentafluoroethyl)phenyl]methyl]-2-phenylhydrazine
CID 169387110
1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169384474
[4-iodo-2-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 127262587
1-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169385923
1-[[2-chloro-6-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169384542
1-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]phenyl]methyl]-2-phenylhydrazine
CID 169385350
1-[(2-chloro-4-fluoro-5-methylphenyl)methyl]-2-phenylhydrazine
CID 169386722
1-[(2,4-dimethylphenyl)methyl]-2-phenylhydrazine
CID 169384445
1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169387097
2-chloro-4-iodo-N-[[2-(trifluoromethyl)phenyl]methyl]aniline
CID 43433530
2-[(2-phenylhydrazinyl)methyl]-4-(trifluoromethoxy)aniline
CID 169386987

Frequently Asked Questions

What is the IUPAC name of 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (CID 169386753) is 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is FC(F)(F)c1cc(I)ccc1CNNc1ccccc1.
What is the InChIKey of 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The InChIKey is AHINEQWCOLWADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3IN2/c15-14(16,17)13-8-11(18)7-6-10(13)9-19-20-12-4-2-1-3-5-12/h1-8,19-20H,9H2.
What are the key properties of 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine has a molecular weight of 392.16 g/mol, XLogP of 4.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169386753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).