4-methoxy-3-methylpyridine

C7H9NO — CID 4737766

IUPAC4-methoxy-3-methylpyridine
SMILESCOc1ccncc1C
InChIInChI=1S/C7H9NO/c1-6-5-8-4-3-7(6)9-2/h3-5H,1-2H3
InChIKeyNCBHMODQBDKRJC-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.40
Rot. Bonds1

About 4-methoxy-3-methylpyridine

4-methoxy-3-methylpyridine (PubChem CID 4737766) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 4-methoxy-3-methylpyridine.

Molecular Properties

Compound Name4-methoxy-3-methylpyridine
PubChem CID4737766
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name4-methoxy-3-methylpyridine
SMILESCOc1ccncc1C
InChIInChI=1S/C7H9NO/c1-6-5-8-4-3-7(6)9-2/h3-5H,1-2H3
InChIKeyNCBHMODQBDKRJC-UHFFFAOYSA-N
XLogP1.40
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-methylpyridine?
The IUPAC name of 4-methoxy-3-methylpyridine (CID 4737766) is 4-methoxy-3-methylpyridine.
What is the SMILES notation for 4-methoxy-3-methylpyridine?
The canonical SMILES for 4-methoxy-3-methylpyridine is COc1ccncc1C.
What is the InChIKey of 4-methoxy-3-methylpyridine?
The InChIKey is NCBHMODQBDKRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-6-5-8-4-3-7(6)9-2/h3-5H,1-2H3.
What are the key properties of 4-methoxy-3-methylpyridine?
4-methoxy-3-methylpyridine has a molecular weight of 123.15 g/mol, XLogP of 1.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-methylpyridine is sourced from PubChem (CID 4737766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).