4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine

C14H14INO2 — CID 157251524

IUPAC4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine
SMILESCOc1ccc(COc2cc(I)c(C)cn2)cc1
InChIInChI=1S/C14H14INO2/c1-10-8-16-14(7-13(10)15)18-9-11-3-5-12(17-2)6-4-11/h3-8H,9H2,1-2H3
InChIKeyLWVOJZZUQODHKE-UHFFFAOYSA-N
MW355.18 g/mol
LogP3.58
Rot. Bonds4

About 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine

4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine (PubChem CID 157251524) has the molecular formula C14H14INO2 and a molecular weight of 355.18 g/mol. Its IUPAC name is 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine.

Molecular Properties

Compound Name4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine
PubChem CID157251524
Molecular FormulaC14H14INO2
Molecular Weight355.18 g/mol
Exact Mass355.01
IUPAC Name4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine
SMILESCOc1ccc(COc2cc(I)c(C)cn2)cc1
InChIInChI=1S/C14H14INO2/c1-10-8-16-14(7-13(10)15)18-9-11-3-5-12(17-2)6-4-11/h3-8H,9H2,1-2H3
InChIKeyLWVOJZZUQODHKE-UHFFFAOYSA-N
XLogP3.58
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(4-methoxyphenyl)methoxy]pyrimidine
CID 162347071
5-iodo-4-[(4-methoxyphenyl)methoxy]pyrimidine
CID 66317781
6-[(4-methoxyphenyl)methoxy]pyridine-3-carbaldehyde
CID 80632122
4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol
CID 157454667
4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline
CID 170076319
4-[(4-methoxyphenyl)methoxy]-2,6-dimethylbenzaldehyde
CID 89075943
2-methoxy-4-[(4-methoxyphenyl)methoxy]pyridine
CID 70697685
2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine
CID 11172203
[6-[(4-methoxyphenyl)methoxy]pyrazin-2-yl]methanamine
CID 66449624
5-fluoro-2-[(4-methoxyphenyl)methoxy]-4-methylpyrimidine
CID 70990513
5-[4-[(4-methoxyphenyl)methoxy]pyrimidin-2-yl]benzene-1,3-diol
CID 67997159
3-methoxy-6-[(4-methoxyphenyl)methoxy]pyrido[2,3-b]pyrazine
CID 59437364

Frequently Asked Questions

What is the IUPAC name of 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine?
The IUPAC name of 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine (CID 157251524) is 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine.
What is the SMILES notation for 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine?
The canonical SMILES for 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine is COc1ccc(COc2cc(I)c(C)cn2)cc1.
What is the InChIKey of 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine?
The InChIKey is LWVOJZZUQODHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14INO2/c1-10-8-16-14(7-13(10)15)18-9-11-3-5-12(17-2)6-4-11/h3-8H,9H2,1-2H3.
What are the key properties of 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine?
4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine has a molecular weight of 355.18 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine is sourced from PubChem (CID 157251524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).