2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine

C13H14N2O2 — CID 162633135

IUPAC2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine
SMILESCCOc1ncccc1-c1ccncc1OC
InChIInChI=1S/C13H14N2O2/c1-3-17-13-11(5-4-7-15-13)10-6-8-14-9-12(10)16-2/h4-9H,3H2,1-2H3
InChIKeyZWVCQBUMXXPFAZ-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.55
Rot. Bonds4

About 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine

2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine (PubChem CID 162633135) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine.

Molecular Properties

Compound Name2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine
PubChem CID162633135
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine
SMILESCCOc1ncccc1-c1ccncc1OC
InChIInChI=1S/C13H14N2O2/c1-3-17-13-11(5-4-7-15-13)10-6-8-14-9-12(10)16-2/h4-9H,3H2,1-2H3
InChIKeyZWVCQBUMXXPFAZ-UHFFFAOYSA-N
XLogP2.55
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine?
The IUPAC name of 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine (CID 162633135) is 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine.
What is the SMILES notation for 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine?
The canonical SMILES for 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine is CCOc1ncccc1-c1ccncc1OC.
What is the InChIKey of 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine?
The InChIKey is ZWVCQBUMXXPFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-3-17-13-11(5-4-7-15-13)10-6-8-14-9-12(10)16-2/h4-9H,3H2,1-2H3.
What are the key properties of 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine?
2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine has a molecular weight of 230.27 g/mol, XLogP of 2.55, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(3-methoxy-4-pyridinyl)pyridine is sourced from PubChem (CID 162633135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).