4-(3,5-dimethoxyphenoxy)pyridine

C13H13NO3 — CID 90751053

IUPAC4-(3,5-dimethoxyphenoxy)pyridine
SMILESCOc1cc(OC)cc(Oc2ccncc2)c1
InChIInChI=1S/C13H13NO3/c1-15-11-7-12(16-2)9-13(8-11)17-10-3-5-14-6-4-10/h3-9H,1-2H3
InChIKeyDPWPQDNBZODKMF-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.89
Rot. Bonds4

About 4-(3,5-dimethoxyphenoxy)pyridine

4-(3,5-dimethoxyphenoxy)pyridine (PubChem CID 90751053) has the molecular formula C13H13NO3 and a molecular weight of 231.25 g/mol. Its IUPAC name is 4-(3,5-dimethoxyphenoxy)pyridine.

Molecular Properties

Compound Name4-(3,5-dimethoxyphenoxy)pyridine
PubChem CID90751053
Molecular FormulaC13H13NO3
Molecular Weight231.25 g/mol
Exact Mass231.09
IUPAC Name4-(3,5-dimethoxyphenoxy)pyridine
SMILESCOc1cc(OC)cc(Oc2ccncc2)c1
InChIInChI=1S/C13H13NO3/c1-15-11-7-12(16-2)9-13(8-11)17-10-3-5-14-6-4-10/h3-9H,1-2H3
InChIKeyDPWPQDNBZODKMF-UHFFFAOYSA-N
XLogP2.89
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxyphenoxy)pyridine?
The IUPAC name of 4-(3,5-dimethoxyphenoxy)pyridine (CID 90751053) is 4-(3,5-dimethoxyphenoxy)pyridine.
What is the SMILES notation for 4-(3,5-dimethoxyphenoxy)pyridine?
The canonical SMILES for 4-(3,5-dimethoxyphenoxy)pyridine is COc1cc(OC)cc(Oc2ccncc2)c1.
What is the InChIKey of 4-(3,5-dimethoxyphenoxy)pyridine?
The InChIKey is DPWPQDNBZODKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3/c1-15-11-7-12(16-2)9-13(8-11)17-10-3-5-14-6-4-10/h3-9H,1-2H3.
What are the key properties of 4-(3,5-dimethoxyphenoxy)pyridine?
4-(3,5-dimethoxyphenoxy)pyridine has a molecular weight of 231.25 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxyphenoxy)pyridine is sourced from PubChem (CID 90751053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).