2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine

C16H13N3O — CID 141419408

IUPAC2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine
SMILESCc1ccc(-c2cc(Oc3cccnc3)ccn2)cn1
InChIInChI=1S/C16H13N3O/c1-12-4-5-13(10-19-12)16-9-14(6-8-18-16)20-15-3-2-7-17-11-15/h2-11H,1H3
InChIKeyQWCSKLJPGAQFQE-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.64
Rot. Bonds3

About 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine

2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine (PubChem CID 141419408) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine.

Molecular Properties

Compound Name2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine
PubChem CID141419408
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine
SMILESCc1ccc(-c2cc(Oc3cccnc3)ccn2)cn1
InChIInChI=1S/C16H13N3O/c1-12-4-5-13(10-19-12)16-9-14(6-8-18-16)20-15-3-2-7-17-11-15/h2-11H,1H3
InChIKeyQWCSKLJPGAQFQE-UHFFFAOYSA-N
XLogP3.64
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 ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine?
The IUPAC name of 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine (CID 141419408) is 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine.
What is the SMILES notation for 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine?
The canonical SMILES for 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine is Cc1ccc(-c2cc(Oc3cccnc3)ccn2)cn1.
What is the InChIKey of 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine?
The InChIKey is QWCSKLJPGAQFQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c1-12-4-5-13(10-19-12)16-9-14(6-8-18-16)20-15-3-2-7-17-11-15/h2-11H,1H3.
What are the key properties of 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine?
2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine has a molecular weight of 263.30 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(4-pyridin-3-yloxy-2-pyridinyl)pyridine is sourced from PubChem (CID 141419408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).