3-(3,4-dimethoxyphenyl)-4-methoxypyridine

C14H15NO3 — CID 71341978

IUPAC3-(3,4-dimethoxyphenyl)-4-methoxypyridine
SMILESCOc1ccc(-c2cnccc2OC)cc1OC
InChIInChI=1S/C14H15NO3/c1-16-12-6-7-15-9-11(12)10-4-5-13(17-2)14(8-10)18-3/h4-9H,1-3H3
InChIKeyGZTCIPBUASGZCM-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.77
Rot. Bonds4

About 3-(3,4-dimethoxyphenyl)-4-methoxypyridine

3-(3,4-dimethoxyphenyl)-4-methoxypyridine (PubChem CID 71341978) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-4-methoxypyridine.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-4-methoxypyridine
PubChem CID71341978
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name3-(3,4-dimethoxyphenyl)-4-methoxypyridine
SMILESCOc1ccc(-c2cnccc2OC)cc1OC
InChIInChI=1S/C14H15NO3/c1-16-12-6-7-15-9-11(12)10-4-5-13(17-2)14(8-10)18-3/h4-9H,1-3H3
InChIKeyGZTCIPBUASGZCM-UHFFFAOYSA-N
XLogP2.77
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-4-methoxypyridine?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-4-methoxypyridine (CID 71341978) is 3-(3,4-dimethoxyphenyl)-4-methoxypyridine.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-4-methoxypyridine?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-4-methoxypyridine is COc1ccc(-c2cnccc2OC)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-4-methoxypyridine?
The InChIKey is GZTCIPBUASGZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-16-12-6-7-15-9-11(12)10-4-5-13(17-2)14(8-10)18-3/h4-9H,1-3H3.
What are the key properties of 3-(3,4-dimethoxyphenyl)-4-methoxypyridine?
3-(3,4-dimethoxyphenyl)-4-methoxypyridine has a molecular weight of 245.28 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-4-methoxypyridine is sourced from PubChem (CID 71341978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).