5-(4-methoxyphenoxy)quinoline

C16H13NO2 — CID 122457274

IUPAC5-(4-methoxyphenoxy)quinoline
SMILESCOc1ccc(Oc2cccc3ncccc23)cc1
InChIInChI=1S/C16H13NO2/c1-18-12-7-9-13(10-8-12)19-16-6-2-5-15-14(16)4-3-11-17-15/h2-11H,1H3
InChIKeyCMMWHMAVXZNVPP-UHFFFAOYSA-N
MW251.28 g/mol
LogP4.04
Rot. Bonds3

About 5-(4-methoxyphenoxy)quinoline

5-(4-methoxyphenoxy)quinoline (PubChem CID 122457274) has the molecular formula C16H13NO2 and a molecular weight of 251.28 g/mol. Its IUPAC name is 5-(4-methoxyphenoxy)quinoline.

Molecular Properties

Compound Name5-(4-methoxyphenoxy)quinoline
PubChem CID122457274
Molecular FormulaC16H13NO2
Molecular Weight251.28 g/mol
Exact Mass251.09
IUPAC Name5-(4-methoxyphenoxy)quinoline
SMILESCOc1ccc(Oc2cccc3ncccc23)cc1
InChIInChI=1S/C16H13NO2/c1-18-12-7-9-13(10-8-12)19-16-6-2-5-15-14(16)4-3-11-17-15/h2-11H,1H3
InChIKeyCMMWHMAVXZNVPP-UHFFFAOYSA-N
XLogP4.04
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenoxy)quinoline?
The IUPAC name of 5-(4-methoxyphenoxy)quinoline (CID 122457274) is 5-(4-methoxyphenoxy)quinoline.
What is the SMILES notation for 5-(4-methoxyphenoxy)quinoline?
The canonical SMILES for 5-(4-methoxyphenoxy)quinoline is COc1ccc(Oc2cccc3ncccc23)cc1.
What is the InChIKey of 5-(4-methoxyphenoxy)quinoline?
The InChIKey is CMMWHMAVXZNVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c1-18-12-7-9-13(10-8-12)19-16-6-2-5-15-14(16)4-3-11-17-15/h2-11H,1H3.
What are the key properties of 5-(4-methoxyphenoxy)quinoline?
5-(4-methoxyphenoxy)quinoline has a molecular weight of 251.28 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenoxy)quinoline is sourced from PubChem (CID 122457274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).