5-phenyl-3-pyridin-2-yl-1,2,4-triazine

C14H10N4 — CID 11637235

IUPAC5-phenyl-3-pyridin-2-yl-1,2,4-triazine
SMILESc1ccc(-c2cnnc(-c3ccccn3)n2)cc1
InChIInChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-18-14(17-13)12-8-4-5-9-15-12/h1-10H
InChIKeyPQIPAPNLNPLMLK-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.60
Rot. Bonds2

About 5-phenyl-3-pyridin-2-yl-1,2,4-triazine

5-phenyl-3-pyridin-2-yl-1,2,4-triazine (PubChem CID 11637235) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-phenyl-3-pyridin-2-yl-1,2,4-triazine.

Molecular Properties

Compound Name5-phenyl-3-pyridin-2-yl-1,2,4-triazine
PubChem CID11637235
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name5-phenyl-3-pyridin-2-yl-1,2,4-triazine
SMILESc1ccc(-c2cnnc(-c3ccccn3)n2)cc1
InChIInChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-18-14(17-13)12-8-4-5-9-15-12/h1-10H
InChIKeyPQIPAPNLNPLMLK-UHFFFAOYSA-N
XLogP2.60
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The IUPAC name of 5-phenyl-3-pyridin-2-yl-1,2,4-triazine (CID 11637235) is 5-phenyl-3-pyridin-2-yl-1,2,4-triazine.
What is the SMILES notation for 5-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The canonical SMILES for 5-phenyl-3-pyridin-2-yl-1,2,4-triazine is c1ccc(-c2cnnc(-c3ccccn3)n2)cc1.
What is the InChIKey of 5-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The InChIKey is PQIPAPNLNPLMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-18-14(17-13)12-8-4-5-9-15-12/h1-10H.
What are the key properties of 5-phenyl-3-pyridin-2-yl-1,2,4-triazine?
5-phenyl-3-pyridin-2-yl-1,2,4-triazine has a molecular weight of 234.26 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-pyridin-2-yl-1,2,4-triazine is sourced from PubChem (CID 11637235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).