3-[4-(methoxymethyl)phenyl]-2-methylpyridine

C14H15NO — CID 90168009

IUPAC3-[4-(methoxymethyl)phenyl]-2-methylpyridine
SMILESCOCc1ccc(-c2cccnc2C)cc1
InChIInChI=1S/C14H15NO/c1-11-14(4-3-9-15-11)13-7-5-12(6-8-13)10-16-2/h3-9H,10H2,1-2H3
InChIKeyMDYPBUFOJPXOFS-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.20
Rot. Bonds3

About 3-[4-(methoxymethyl)phenyl]-2-methylpyridine

3-[4-(methoxymethyl)phenyl]-2-methylpyridine (PubChem CID 90168009) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-[4-(methoxymethyl)phenyl]-2-methylpyridine.

Molecular Properties

Compound Name3-[4-(methoxymethyl)phenyl]-2-methylpyridine
PubChem CID90168009
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name3-[4-(methoxymethyl)phenyl]-2-methylpyridine
SMILESCOCc1ccc(-c2cccnc2C)cc1
InChIInChI=1S/C14H15NO/c1-11-14(4-3-9-15-11)13-7-5-12(6-8-13)10-16-2/h3-9H,10H2,1-2H3
InChIKeyMDYPBUFOJPXOFS-UHFFFAOYSA-N
XLogP3.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(methoxymethyl)phenyl]-2-methylpyridine?
The IUPAC name of 3-[4-(methoxymethyl)phenyl]-2-methylpyridine (CID 90168009) is 3-[4-(methoxymethyl)phenyl]-2-methylpyridine.
What is the SMILES notation for 3-[4-(methoxymethyl)phenyl]-2-methylpyridine?
The canonical SMILES for 3-[4-(methoxymethyl)phenyl]-2-methylpyridine is COCc1ccc(-c2cccnc2C)cc1.
What is the InChIKey of 3-[4-(methoxymethyl)phenyl]-2-methylpyridine?
The InChIKey is MDYPBUFOJPXOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-14(4-3-9-15-11)13-7-5-12(6-8-13)10-16-2/h3-9H,10H2,1-2H3.
What are the key properties of 3-[4-(methoxymethyl)phenyl]-2-methylpyridine?
3-[4-(methoxymethyl)phenyl]-2-methylpyridine has a molecular weight of 213.28 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(methoxymethyl)phenyl]-2-methylpyridine is sourced from PubChem (CID 90168009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).