2-methyl-1,3,5-triazine

C4H5N3 — CID 19208

IUPAC2-methyl-1,3,5-triazine
SMILESCc1ncncn1
InChIInChI=1S/C4H5N3/c1-4-6-2-5-3-7-4/h2-3H,1H3
InChIKeyYIUOAAUFVBZQPM-UHFFFAOYSA-N
MW95.10 g/mol
LogP0.18
Rot. Bonds

About 2-methyl-1,3,5-triazine

2-methyl-1,3,5-triazine (PubChem CID 19208) has the molecular formula C4H5N3 and a molecular weight of 95.10 g/mol. Its IUPAC name is 2-methyl-1,3,5-triazine.

Molecular Properties

Compound Name2-methyl-1,3,5-triazine
PubChem CID19208
Molecular FormulaC4H5N3
Molecular Weight95.10 g/mol
Exact Mass95.05
IUPAC Name2-methyl-1,3,5-triazine
SMILESCc1ncncn1
InChIInChI=1S/C4H5N3/c1-4-6-2-5-3-7-4/h2-3H,1H3
InChIKeyYIUOAAUFVBZQPM-UHFFFAOYSA-N
XLogP0.18
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.10
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3,5-triazine?
The IUPAC name of 2-methyl-1,3,5-triazine (CID 19208) is 2-methyl-1,3,5-triazine.
What is the SMILES notation for 2-methyl-1,3,5-triazine?
The canonical SMILES for 2-methyl-1,3,5-triazine is Cc1ncncn1.
What is the InChIKey of 2-methyl-1,3,5-triazine?
The InChIKey is YIUOAAUFVBZQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3/c1-4-6-2-5-3-7-4/h2-3H,1H3.
What are the key properties of 2-methyl-1,3,5-triazine?
2-methyl-1,3,5-triazine has a molecular weight of 95.10 g/mol, XLogP of 0.18, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3,5-triazine is sourced from PubChem (CID 19208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).