4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine

Name: 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₂H₁₄N₂O — CID 82896081

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine

SMILESCOc1cc(C)nc(Cn2cccc2)c1

InChIInChI=1S/C12H14N2O/c1-10-7-12(15-2)8-11(13-10)9-14-5-3-4-6-14/h3-8H,9H2,1-2H3

InChIKeyZMNOWCJCSJCXRJ-UHFFFAOYSA-N

MW202.26 g/mol

LogP2.25

Rot. Bonds3

About 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine

4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine (PubChem CID 82896081) has the molecular formula C₁₂H₁₄N₂O and a molecular weight of 202.26 g/mol. Its IUPAC name is 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine.

Molecular Properties

Compound Name	4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine
PubChem CID	82896081
Molecular Formula	C₁₂H₁₄N₂O
Molecular Weight	202.26 g/mol
Exact Mass	202.11
IUPAC Name	4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine
SMILES	COc1cc(C)nc(Cn2cccc2)c1
InChI	InChI=1S/C12H14N2O/c1-10-7-12(15-2)8-11(13-10)9-14-5-3-4-6-14/h3-8H,9H2,1-2H3
InChIKey	ZMNOWCJCSJCXRJ-UHFFFAOYSA-N
XLogP	2.25
TPSA	27.05 Å²
H-Bond Donors
H-Bond Acceptors	3
Rotatable Bonds	3
Heavy Atoms	15
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	202.26
LogP ≤ 5	2.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine?

The IUPAC name of 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine (CID 82896081) is 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine.

What is the SMILES notation for 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine?

The canonical SMILES for 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine is COc1cc(C)nc(Cn2cccc2)c1.

What is the InChIKey of 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine?

The InChIKey is ZMNOWCJCSJCXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10-7-12(15-2)8-11(13-10)9-14-5-3-4-6-14/h3-8H,9H2,1-2H3.

What are the key properties of 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine?

4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine has a molecular weight of 202.26 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine is sourced from PubChem (CID 82896081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 82896081 — identifiers, structure, computed properties (public domain)

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