4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine

C16H13N3O — CID 162646387

IUPAC4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine
SMILESCOc1cc(-c2cccnc2)nc(-c2ccccn2)c1
InChIInChI=1S/C16H13N3O/c1-20-13-9-15(12-5-4-7-17-11-12)19-16(10-13)14-6-2-3-8-18-14/h2-11H,1H3
InChIKeyMAWRSSLUUNLHFE-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.21
Rot. Bonds3

About 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine

4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine (PubChem CID 162646387) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine.

Molecular Properties

Compound Name4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine
PubChem CID162646387
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine
SMILESCOc1cc(-c2cccnc2)nc(-c2ccccn2)c1
InChIInChI=1S/C16H13N3O/c1-20-13-9-15(12-5-4-7-17-11-12)19-16(10-13)14-6-2-3-8-18-14/h2-11H,1H3
InChIKeyMAWRSSLUUNLHFE-UHFFFAOYSA-N
XLogP3.21
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine?
The IUPAC name of 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine (CID 162646387) is 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine.
What is the SMILES notation for 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine?
The canonical SMILES for 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine is COc1cc(-c2cccnc2)nc(-c2ccccn2)c1.
What is the InChIKey of 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine?
The InChIKey is MAWRSSLUUNLHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c1-20-13-9-15(12-5-4-7-17-11-12)19-16(10-13)14-6-2-3-8-18-14/h2-11H,1H3.
What are the key properties of 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine?
4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine has a molecular weight of 263.30 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-pyridin-2-yl-6-pyridin-3-ylpyridine is sourced from PubChem (CID 162646387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).