5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine

C14H9ClN4 — CID 14642993

IUPAC5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine
SMILESClc1nc(-c2ccccn2)nnc1-c1ccccc1
InChIInChI=1S/C14H9ClN4/c15-13-12(10-6-2-1-3-7-10)18-19-14(17-13)11-8-4-5-9-16-11/h1-9H
InChIKeyPBTQWNREAONKRA-UHFFFAOYSA-N
MW268.71 g/mol
LogP3.25
Rot. Bonds2

About 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine

5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine (PubChem CID 14642993) has the molecular formula C14H9ClN4 and a molecular weight of 268.71 g/mol. Its IUPAC name is 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine.

Molecular Properties

Compound Name5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine
PubChem CID14642993
Molecular FormulaC14H9ClN4
Molecular Weight268.71 g/mol
Exact Mass268.05
IUPAC Name5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine
SMILESClc1nc(-c2ccccn2)nnc1-c1ccccc1
InChIInChI=1S/C14H9ClN4/c15-13-12(10-6-2-1-3-7-10)18-19-14(17-13)11-8-4-5-9-16-11/h1-9H
InChIKeyPBTQWNREAONKRA-UHFFFAOYSA-N
XLogP3.25
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.71
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-6-phenyl-3-pyridin-2-yl-1,2,4-triazine
CID 6405145
6-phenyl-3-pyridin-2-yl-5-(4-pyridin-4-ylpiperazin-1-yl)-1,2,4-triazine
CID 45099949
4-chloro-2-pyridin-2-ylquinazoline
CID 930716
6-phenyl-3-pyridin-2-yl-1,2,4-triazine
CID 6405118
4,6-dichloro-5-(4-chlorophenyl)-2-pyridin-2-ylpyrimidine
CID 79432804
N-(3,4-difluorophenyl)-6-phenyl-3-pyridin-2-yl-1,2,4-triazin-5-amine
CID 146048292
hydrazine;2-phenylpyridine
CID 158673997
6-phenyl-3-pyridin-2-yl-N-(2,3,4,5-tetrafluorophenyl)-1,2,4-triazin-5-amine
CID 146048319
4,6-diphenyl-2-pyridin-2-ylpyrimidine;ethane
CID 145283767
2-[3-(2-phenylphenyl)phenyl]pyridine
CID 59403973
4-chloro-2-(3-pyridin-2-ylphenyl)quinazoline
CID 166908308
2-(3,5-dipyridin-2-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 59510704

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The IUPAC name of 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine (CID 14642993) is 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine.
What is the SMILES notation for 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The canonical SMILES for 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine is Clc1nc(-c2ccccn2)nnc1-c1ccccc1.
What is the InChIKey of 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine?
The InChIKey is PBTQWNREAONKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN4/c15-13-12(10-6-2-1-3-7-10)18-19-14(17-13)11-8-4-5-9-16-11/h1-9H.
What are the key properties of 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine?
5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine has a molecular weight of 268.71 g/mol, XLogP of 3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-phenyl-3-pyridin-2-yl-1,2,4-triazine is sourced from PubChem (CID 14642993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).