4,6-difluoro-2-methylpyrimidine

C5H4F2N2 — CID 18981184

IUPAC4,6-difluoro-2-methylpyrimidine
SMILESCc1nc(F)cc(F)n1
InChIInChI=1S/C5H4F2N2/c1-3-8-4(6)2-5(7)9-3/h2H,1H3
InChIKeyALVMGJVBZPATCW-UHFFFAOYSA-N
MW130.10 g/mol
LogP1.06
Rot. Bonds

About 4,6-difluoro-2-methylpyrimidine

4,6-difluoro-2-methylpyrimidine (PubChem CID 18981184) has the molecular formula C5H4F2N2 and a molecular weight of 130.10 g/mol. Its IUPAC name is 4,6-difluoro-2-methylpyrimidine.

Molecular Properties

Compound Name4,6-difluoro-2-methylpyrimidine
PubChem CID18981184
Molecular FormulaC5H4F2N2
Molecular Weight130.10 g/mol
Exact Mass130.03
IUPAC Name4,6-difluoro-2-methylpyrimidine
SMILESCc1nc(F)cc(F)n1
InChIInChI=1S/C5H4F2N2/c1-3-8-4(6)2-5(7)9-3/h2H,1H3
InChIKeyALVMGJVBZPATCW-UHFFFAOYSA-N
XLogP1.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.10
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-difluoro-2-methylpyrimidine?
The IUPAC name of 4,6-difluoro-2-methylpyrimidine (CID 18981184) is 4,6-difluoro-2-methylpyrimidine.
What is the SMILES notation for 4,6-difluoro-2-methylpyrimidine?
The canonical SMILES for 4,6-difluoro-2-methylpyrimidine is Cc1nc(F)cc(F)n1.
What is the InChIKey of 4,6-difluoro-2-methylpyrimidine?
The InChIKey is ALVMGJVBZPATCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4F2N2/c1-3-8-4(6)2-5(7)9-3/h2H,1H3.
What are the key properties of 4,6-difluoro-2-methylpyrimidine?
4,6-difluoro-2-methylpyrimidine has a molecular weight of 130.10 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-difluoro-2-methylpyrimidine is sourced from PubChem (CID 18981184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).