2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine

C14H12N4O — CID 140729240

IUPAC2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine
SMILESCc1cc(-c2cccc(Oc3ccccn3)n2)n[nH]1
InChIInChI=1S/C14H12N4O/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13/h2-9H,1H3,(H,17,18)
InChIKeyIESYGMGSEBFHPV-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.97
Rot. Bonds3

About 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine

2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine (PubChem CID 140729240) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine.

Molecular Properties

Compound Name2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine
PubChem CID140729240
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine
SMILESCc1cc(-c2cccc(Oc3ccccn3)n2)n[nH]1
InChIInChI=1S/C14H12N4O/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13/h2-9H,1H3,(H,17,18)
InChIKeyIESYGMGSEBFHPV-UHFFFAOYSA-N
XLogP2.97
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine?
The IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine (CID 140729240) is 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine.
What is the SMILES notation for 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine?
The canonical SMILES for 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine is Cc1cc(-c2cccc(Oc3ccccn3)n2)n[nH]1.
What is the InChIKey of 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine?
The InChIKey is IESYGMGSEBFHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13/h2-9H,1H3,(H,17,18).
What are the key properties of 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine?
2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine has a molecular weight of 252.28 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-pyrazol-3-yl)-6-pyridin-2-yloxypyridine is sourced from PubChem (CID 140729240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).