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

C12H14N2O — CID 82896081

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 Name4-methoxy-2-methyl-6-(pyrrol-1-ylmethyl)pyridine
PubChem CID82896081
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name4-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
XLogP2.25
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]indole
CID 116619485
2-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrol-2-yl]ethanamine
CID 82895978
1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrol-2-yl]ethanol
CID 82895318
2,2,2-trifluoro-1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrol-3-yl]ethanol
CID 82885297
1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrol-3-yl]butan-1-ol
CID 82895596
1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrol-2-yl]-N-methylethanamine
CID 82896153
O-[(4-methoxy-6-methyl-2-pyridinyl)methyl]hydroxylamine
CID 82893104
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3,5-dimethylpiperazine
CID 82893576
(4-methoxy-6-methyl-2-pyridinyl)methylhydrazine
CID 82893343
2-[[4-(chloromethyl)-3,5-dimethylpyrazol-1-yl]methyl]-4-methoxy-6-methylpyridine
CID 82895598
8-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 82892806
2-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrrol-4-ol
CID 83211745

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).