4-chloro-2,6-difluoropyrimidine

C4HClF2N2 — CID 21259054

IUPAC4-chloro-2,6-difluoropyrimidine
SMILESFc1cc(Cl)nc(F)n1
InChIInChI=1S/C4HClF2N2/c5-2-1-3(6)9-4(7)8-2/h1H
InChIKeyACYSJALOFWHUEX-UHFFFAOYSA-N
MW150.52 g/mol
LogP1.41
Rot. Bonds

About 4-chloro-2,6-difluoropyrimidine

4-chloro-2,6-difluoropyrimidine (PubChem CID 21259054) has the molecular formula C4HClF2N2 and a molecular weight of 150.52 g/mol. Its IUPAC name is 4-chloro-2,6-difluoropyrimidine.

Molecular Properties

Compound Name4-chloro-2,6-difluoropyrimidine
PubChem CID21259054
Molecular FormulaC4HClF2N2
Molecular Weight150.52 g/mol
Exact Mass149.98
IUPAC Name4-chloro-2,6-difluoropyrimidine
SMILESFc1cc(Cl)nc(F)n1
InChIInChI=1S/C4HClF2N2/c5-2-1-3(6)9-4(7)8-2/h1H
InChIKeyACYSJALOFWHUEX-UHFFFAOYSA-N
XLogP1.41
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.52
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,6-difluoropyrimidine?
The IUPAC name of 4-chloro-2,6-difluoropyrimidine (CID 21259054) is 4-chloro-2,6-difluoropyrimidine.
What is the SMILES notation for 4-chloro-2,6-difluoropyrimidine?
The canonical SMILES for 4-chloro-2,6-difluoropyrimidine is Fc1cc(Cl)nc(F)n1.
What is the InChIKey of 4-chloro-2,6-difluoropyrimidine?
The InChIKey is ACYSJALOFWHUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HClF2N2/c5-2-1-3(6)9-4(7)8-2/h1H.
What are the key properties of 4-chloro-2,6-difluoropyrimidine?
4-chloro-2,6-difluoropyrimidine has a molecular weight of 150.52 g/mol, XLogP of 1.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,6-difluoropyrimidine is sourced from PubChem (CID 21259054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).