4-methyl-6-prop-1-enyltriazine

C7H9N3 — CID 67456610

IUPAC4-methyl-6-prop-1-enyltriazine
SMILESCC=Cc1cc(C)nnn1
InChIInChI=1S/C7H9N3/c1-3-4-7-5-6(2)8-10-9-7/h3-5H,1-2H3
InChIKeyMMXUQCVIKXPHCN-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.21
Rot. Bonds1

About 4-methyl-6-prop-1-enyltriazine

4-methyl-6-prop-1-enyltriazine (PubChem CID 67456610) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 4-methyl-6-prop-1-enyltriazine.

Molecular Properties

Compound Name4-methyl-6-prop-1-enyltriazine
PubChem CID67456610
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name4-methyl-6-prop-1-enyltriazine
SMILESCC=Cc1cc(C)nnn1
InChIInChI=1S/C7H9N3/c1-3-4-7-5-6(2)8-10-9-7/h3-5H,1-2H3
InChIKeyMMXUQCVIKXPHCN-UHFFFAOYSA-N
XLogP1.21
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-prop-1-enyltriazine?
The IUPAC name of 4-methyl-6-prop-1-enyltriazine (CID 67456610) is 4-methyl-6-prop-1-enyltriazine.
What is the SMILES notation for 4-methyl-6-prop-1-enyltriazine?
The canonical SMILES for 4-methyl-6-prop-1-enyltriazine is CC=Cc1cc(C)nnn1.
What is the InChIKey of 4-methyl-6-prop-1-enyltriazine?
The InChIKey is MMXUQCVIKXPHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-3-4-7-5-6(2)8-10-9-7/h3-5H,1-2H3.
What are the key properties of 4-methyl-6-prop-1-enyltriazine?
4-methyl-6-prop-1-enyltriazine has a molecular weight of 135.17 g/mol, XLogP of 1.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-prop-1-enyltriazine is sourced from PubChem (CID 67456610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).