2,5-dimethylpyrimidine

C6H8N2 — CID 535856

IUPAC2,5-dimethylpyrimidine
SMILESCc1cnc(C)nc1
InChIInChI=1S/C6H8N2/c1-5-3-7-6(2)8-4-5/h3-4H,1-2H3
InChIKeyRHOOLJLEYYXKTK-UHFFFAOYSA-N
MW108.14 g/mol
LogP1.09
Rot. Bonds

About 2,5-dimethylpyrimidine

2,5-dimethylpyrimidine (PubChem CID 535856) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 2,5-dimethylpyrimidine.

Molecular Properties

Compound Name2,5-dimethylpyrimidine
PubChem CID535856
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name2,5-dimethylpyrimidine
SMILESCc1cnc(C)nc1
InChIInChI=1S/C6H8N2/c1-5-3-7-6(2)8-4-5/h3-4H,1-2H3
InChIKeyRHOOLJLEYYXKTK-UHFFFAOYSA-N
XLogP1.09
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrimidine?
The IUPAC name of 2,5-dimethylpyrimidine (CID 535856) is 2,5-dimethylpyrimidine.
What is the SMILES notation for 2,5-dimethylpyrimidine?
The canonical SMILES for 2,5-dimethylpyrimidine is Cc1cnc(C)nc1.
What is the InChIKey of 2,5-dimethylpyrimidine?
The InChIKey is RHOOLJLEYYXKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-5-3-7-6(2)8-4-5/h3-4H,1-2H3.
What are the key properties of 2,5-dimethylpyrimidine?
2,5-dimethylpyrimidine has a molecular weight of 108.14 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrimidine is sourced from PubChem (CID 535856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).