2-(4-methoxy-3-pyridinyl)-5-methylpyridine

C12H12N2O — CID 91514165

IUPAC2-(4-methoxy-3-pyridinyl)-5-methylpyridine
SMILESCOc1ccncc1-c1ccc(C)cn1
InChIInChI=1S/C12H12N2O/c1-9-3-4-11(14-7-9)10-8-13-6-5-12(10)15-2/h3-8H,1-2H3
InChIKeyPEZNMOZGPXXPMV-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.46
Rot. Bonds2

About 2-(4-methoxy-3-pyridinyl)-5-methylpyridine

2-(4-methoxy-3-pyridinyl)-5-methylpyridine (PubChem CID 91514165) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-(4-methoxy-3-pyridinyl)-5-methylpyridine.

Molecular Properties

Compound Name2-(4-methoxy-3-pyridinyl)-5-methylpyridine
PubChem CID91514165
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2-(4-methoxy-3-pyridinyl)-5-methylpyridine
SMILESCOc1ccncc1-c1ccc(C)cn1
InChIInChI=1S/C12H12N2O/c1-9-3-4-11(14-7-9)10-8-13-6-5-12(10)15-2/h3-8H,1-2H3
InChIKeyPEZNMOZGPXXPMV-UHFFFAOYSA-N
XLogP2.46
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-pyridinyl)-5-methylpyridine?
The IUPAC name of 2-(4-methoxy-3-pyridinyl)-5-methylpyridine (CID 91514165) is 2-(4-methoxy-3-pyridinyl)-5-methylpyridine.
What is the SMILES notation for 2-(4-methoxy-3-pyridinyl)-5-methylpyridine?
The canonical SMILES for 2-(4-methoxy-3-pyridinyl)-5-methylpyridine is COc1ccncc1-c1ccc(C)cn1.
What is the InChIKey of 2-(4-methoxy-3-pyridinyl)-5-methylpyridine?
The InChIKey is PEZNMOZGPXXPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-3-4-11(14-7-9)10-8-13-6-5-12(10)15-2/h3-8H,1-2H3.
What are the key properties of 2-(4-methoxy-3-pyridinyl)-5-methylpyridine?
2-(4-methoxy-3-pyridinyl)-5-methylpyridine has a molecular weight of 200.24 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-pyridinyl)-5-methylpyridine is sourced from PubChem (CID 91514165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).