2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol

C14H11FINO — CID 135988559

IUPAC2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol
SMILESCc1cc(I)c(O)c(/C=N/c2ccccc2F)c1
InChIInChI=1S/C14H11FINO/c1-9-6-10(14(18)12(16)7-9)8-17-13-5-3-2-4-11(13)15/h2-8,18H,1H3/b17-8+
InChIKeyIIPAMFJRLNMQGP-CAOOACKPSA-N
MW355.15 g/mol
LogP4.19
Rot. Bonds2

About 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol

2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol (PubChem CID 135988559) has the molecular formula C14H11FINO and a molecular weight of 355.15 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol.

Molecular Properties

Compound Name2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol
PubChem CID135988559
Molecular FormulaC14H11FINO
Molecular Weight355.15 g/mol
Exact Mass354.99
IUPAC Name2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol
SMILESCc1cc(I)c(O)c(/C=N/c2ccccc2F)c1
InChIInChI=1S/C14H11FINO/c1-9-6-10(14(18)12(16)7-9)8-17-13-5-3-2-4-11(13)15/h2-8,18H,1H3/b17-8+
InChIKeyIIPAMFJRLNMQGP-CAOOACKPSA-N
XLogP4.19
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.15
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-iodo-4-methyl-6-(phenyliminomethyl)phenol
CID 135988546
2-[(2-hydroxy-4,5-dimethylphenyl)iminomethyl]-6-iodo-4-methylphenol
CID 171980248
4-methyl-2,6-bis[(2-methylsulfanylphenyl)iminomethyl]phenol
CID 136797753
4-bromo-2-[(2-hydroxyphenyl)iminomethyl]-6-iodophenol
CID 137173243
2-[(2-fluoro-5-methylphenyl)iminomethyl]phenol
CID 4857118
ethyl 4-[(2-hydroxy-3-iodo-5-methylphenyl)methylideneamino]benzoate
CID 4095582
2-bromo-6-[(2-chlorophenyl)iminomethyl]-4-methylphenol
CID 757958
2-[[8-[(2-hydroxy-3,5-dimethylphenyl)methylideneamino]naphthalen-1-yl]iminomethyl]-4,6-dimethylphenol
CID 137032211
4-bromo-2-iodo-6-[(2-methoxyphenyl)iminomethyl]phenol
CID 137043389
4-chloro-2-[(2-fluorophenyl)iminomethyl]-6-nitrophenol
CID 135595163
2-iodo-4-methyl-6-[(2-phenyl-3H-indol-6-yl)iminomethyl]phenol
CID 158401781
2-[(2-fluorophenyl)methylideneamino]phenol
CID 677307

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol?
The IUPAC name of 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol (CID 135988559) is 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol.
What is the SMILES notation for 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol?
The canonical SMILES for 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol is Cc1cc(I)c(O)c(/C=N/c2ccccc2F)c1.
What is the InChIKey of 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol?
The InChIKey is IIPAMFJRLNMQGP-CAOOACKPSA-N. The full InChI is InChI=1S/C14H11FINO/c1-9-6-10(14(18)12(16)7-9)8-17-13-5-3-2-4-11(13)15/h2-8,18H,1H3/b17-8+.
What are the key properties of 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol?
2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol has a molecular weight of 355.15 g/mol, XLogP of 4.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)iminomethyl]-6-iodo-4-methylphenol is sourced from PubChem (CID 135988559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).