[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine

C14H11F4IN2 — CID 107292549

IUPAC[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(C(F)(F)F)c1)c1ccccc1I
InChIInChI=1S/C14H11F4IN2/c15-11-6-5-8(7-10(11)14(16,17)18)13(21-20)9-3-1-2-4-12(9)19/h1-7,13,21H,20H2
InChIKeyVIIFTCIVTLDCTC-UHFFFAOYSA-N
MW410.15 g/mol
LogP4.00
Rot. Bonds3

About [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine

[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine (PubChem CID 107292549) has the molecular formula C14H11F4IN2 and a molecular weight of 410.15 g/mol. Its IUPAC name is [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine
PubChem CID107292549
Molecular FormulaC14H11F4IN2
Molecular Weight410.15 g/mol
Exact Mass409.99
IUPAC Name[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(C(F)(F)F)c1)c1ccccc1I
InChIInChI=1S/C14H11F4IN2/c15-11-6-5-8(7-10(11)14(16,17)18)13(21-20)9-3-1-2-4-12(9)19/h1-7,13,21H,20H2
InChIKeyVIIFTCIVTLDCTC-UHFFFAOYSA-N
XLogP4.00
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.15
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[[4-fluoro-3-(trifluoromethyl)phenyl]-hydrazinylmethyl]aniline
CID 107292299
[(3-chlorophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105289210
[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105335389
[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292244
[[4-fluoro-3-(trifluoromethyl)phenyl]-(4-methylthiophen-3-yl)methyl]hydrazine
CID 107292364
[(2-iodophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710449
1-[4-fluoro-3-(trifluoromethyl)phenyl]-N-methyl-1-(2-methylphenyl)methanamine
CID 115794840
[(2-iodophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105304253
[2,3-dihydro-1-benzofuran-5-yl-(2-iodophenyl)methyl]hydrazine
CID 105333859
[(2,3-difluorophenyl)-naphthalen-2-ylmethyl]hydrazine
CID 105213346
[(4-methoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105190882
[(4-chloro-2-fluorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105217891

Frequently Asked Questions

What is the IUPAC name of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine?
The IUPAC name of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine (CID 107292549) is [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine.
What is the SMILES notation for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine?
The canonical SMILES for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine is NNC(c1ccc(F)c(C(F)(F)F)c1)c1ccccc1I.
What is the InChIKey of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine?
The InChIKey is VIIFTCIVTLDCTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F4IN2/c15-11-6-5-8(7-10(11)14(16,17)18)13(21-20)9-3-1-2-4-12(9)19/h1-7,13,21H,20H2.
What are the key properties of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine?
[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine has a molecular weight of 410.15 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine is sourced from PubChem (CID 107292549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).