4-ethyl-5-fluoro-2,6-dimethylpyrimidine

C8H11FN2 — CID 23544404

IUPAC4-ethyl-5-fluoro-2,6-dimethylpyrimidine
SMILESCCc1nc(C)nc(C)c1F
InChIInChI=1S/C8H11FN2/c1-4-7-8(9)5(2)10-6(3)11-7/h4H2,1-3H3
InChIKeyASNWEZNLGJHGJK-UHFFFAOYSA-N
MW154.19 g/mol
LogP1.79
Rot. Bonds1

About 4-ethyl-5-fluoro-2,6-dimethylpyrimidine

4-ethyl-5-fluoro-2,6-dimethylpyrimidine (PubChem CID 23544404) has the molecular formula C8H11FN2 and a molecular weight of 154.19 g/mol. Its IUPAC name is 4-ethyl-5-fluoro-2,6-dimethylpyrimidine.

Molecular Properties

Compound Name4-ethyl-5-fluoro-2,6-dimethylpyrimidine
PubChem CID23544404
Molecular FormulaC8H11FN2
Molecular Weight154.19 g/mol
Exact Mass154.09
IUPAC Name4-ethyl-5-fluoro-2,6-dimethylpyrimidine
SMILESCCc1nc(C)nc(C)c1F
InChIInChI=1S/C8H11FN2/c1-4-7-8(9)5(2)10-6(3)11-7/h4H2,1-3H3
InChIKeyASNWEZNLGJHGJK-UHFFFAOYSA-N
XLogP1.79
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-5-fluoro-2,6-dimethylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-fluoro-2,6-dimethylpyrimidine?
The IUPAC name of 4-ethyl-5-fluoro-2,6-dimethylpyrimidine (CID 23544404) is 4-ethyl-5-fluoro-2,6-dimethylpyrimidine.
What is the SMILES notation for 4-ethyl-5-fluoro-2,6-dimethylpyrimidine?
The canonical SMILES for 4-ethyl-5-fluoro-2,6-dimethylpyrimidine is CCc1nc(C)nc(C)c1F.
What is the InChIKey of 4-ethyl-5-fluoro-2,6-dimethylpyrimidine?
The InChIKey is ASNWEZNLGJHGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2/c1-4-7-8(9)5(2)10-6(3)11-7/h4H2,1-3H3.
What are the key properties of 4-ethyl-5-fluoro-2,6-dimethylpyrimidine?
4-ethyl-5-fluoro-2,6-dimethylpyrimidine has a molecular weight of 154.19 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-fluoro-2,6-dimethylpyrimidine is sourced from PubChem (CID 23544404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).