5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine

C12H14N4 — CID 12720255

IUPAC5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine
SMILESCCCc1nnc(-c2ccccn2)nc1C
InChIInChI=1S/C12H14N4/c1-3-6-10-9(2)14-12(16-15-10)11-7-4-5-8-13-11/h4-5,7-8H,3,6H2,1-2H3
InChIKeyNZWWKFXTVAFXRZ-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.19
Rot. Bonds3

About 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine

5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine (PubChem CID 12720255) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine.

Molecular Properties

Compound Name5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine
PubChem CID12720255
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine
SMILESCCCc1nnc(-c2ccccn2)nc1C
InChIInChI=1S/C12H14N4/c1-3-6-10-9(2)14-12(16-15-10)11-7-4-5-8-13-11/h4-5,7-8H,3,6H2,1-2H3
InChIKeyNZWWKFXTVAFXRZ-UHFFFAOYSA-N
XLogP2.19
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine?
The IUPAC name of 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine (CID 12720255) is 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine.
What is the SMILES notation for 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine?
The canonical SMILES for 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine is CCCc1nnc(-c2ccccn2)nc1C.
What is the InChIKey of 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine?
The InChIKey is NZWWKFXTVAFXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-3-6-10-9(2)14-12(16-15-10)11-7-4-5-8-13-11/h4-5,7-8H,3,6H2,1-2H3.
What are the key properties of 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine?
5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine has a molecular weight of 214.27 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-propyl-3-pyridin-2-yl-1,2,4-triazine is sourced from PubChem (CID 12720255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).