3,4-dimethoxy-2-methylpyridine

C8H11NO2 — CID 639879

IUPAC3,4-dimethoxy-2-methylpyridine
SMILESCOc1ccnc(C)c1OC
InChIInChI=1S/C8H11NO2/c1-6-8(11-3)7(10-2)4-5-9-6/h4-5H,1-3H3
InChIKeyVPGBIRMKRPLRKJ-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.41
Rot. Bonds2

About 3,4-dimethoxy-2-methylpyridine

3,4-dimethoxy-2-methylpyridine (PubChem CID 639879) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 3,4-dimethoxy-2-methylpyridine.

Molecular Properties

Compound Name3,4-dimethoxy-2-methylpyridine
PubChem CID639879
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name3,4-dimethoxy-2-methylpyridine
SMILESCOc1ccnc(C)c1OC
InChIInChI=1S/C8H11NO2/c1-6-8(11-3)7(10-2)4-5-9-6/h4-5H,1-3H3
InChIKeyVPGBIRMKRPLRKJ-UHFFFAOYSA-N
XLogP1.41
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-2-methylpyridine?
The IUPAC name of 3,4-dimethoxy-2-methylpyridine (CID 639879) is 3,4-dimethoxy-2-methylpyridine.
What is the SMILES notation for 3,4-dimethoxy-2-methylpyridine?
The canonical SMILES for 3,4-dimethoxy-2-methylpyridine is COc1ccnc(C)c1OC.
What is the InChIKey of 3,4-dimethoxy-2-methylpyridine?
The InChIKey is VPGBIRMKRPLRKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-6-8(11-3)7(10-2)4-5-9-6/h4-5H,1-3H3.
What are the key properties of 3,4-dimethoxy-2-methylpyridine?
3,4-dimethoxy-2-methylpyridine has a molecular weight of 153.18 g/mol, XLogP of 1.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-2-methylpyridine is sourced from PubChem (CID 639879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).