2-[(4-methoxyphenyl)methyl]pyridine

C13H13NO — CID 607809

IUPAC2-[(4-methoxyphenyl)methyl]pyridine
SMILESCOc1ccc(Cc2ccccn2)cc1
InChIInChI=1S/C13H13NO/c1-15-13-7-5-11(6-8-13)10-12-4-2-3-9-14-12/h2-9H,10H2,1H3
InChIKeyRAYSFVXANSJEHT-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.68
Rot. Bonds3

About 2-[(4-methoxyphenyl)methyl]pyridine

2-[(4-methoxyphenyl)methyl]pyridine (PubChem CID 607809) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)methyl]pyridine.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)methyl]pyridine
PubChem CID607809
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name2-[(4-methoxyphenyl)methyl]pyridine
SMILESCOc1ccc(Cc2ccccn2)cc1
InChIInChI=1S/C13H13NO/c1-15-13-7-5-11(6-8-13)10-12-4-2-3-9-14-12/h2-9H,10H2,1H3
InChIKeyRAYSFVXANSJEHT-UHFFFAOYSA-N
XLogP2.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)methyl]pyridine?
The IUPAC name of 2-[(4-methoxyphenyl)methyl]pyridine (CID 607809) is 2-[(4-methoxyphenyl)methyl]pyridine.
What is the SMILES notation for 2-[(4-methoxyphenyl)methyl]pyridine?
The canonical SMILES for 2-[(4-methoxyphenyl)methyl]pyridine is COc1ccc(Cc2ccccn2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)methyl]pyridine?
The InChIKey is RAYSFVXANSJEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-15-13-7-5-11(6-8-13)10-12-4-2-3-9-14-12/h2-9H,10H2,1H3.
What are the key properties of 2-[(4-methoxyphenyl)methyl]pyridine?
2-[(4-methoxyphenyl)methyl]pyridine has a molecular weight of 199.25 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)methyl]pyridine is sourced from PubChem (CID 607809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).