4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine

C10H5Cl2FN2O — CID 11230678

IUPAC4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine
SMILESFc1c(Cl)ncnc1Oc1ccccc1Cl
InChIInChI=1S/C10H5Cl2FN2O/c11-6-3-1-2-4-7(6)16-10-8(13)9(12)14-5-15-10/h1-5H
InChIKeyRGBIKVOIODUDLX-UHFFFAOYSA-N
MW259.07 g/mol
LogP3.71
Rot. Bonds2

About 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine

4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine (PubChem CID 11230678) has the molecular formula C10H5Cl2FN2O and a molecular weight of 259.07 g/mol. Its IUPAC name is 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine.

Molecular Properties

Compound Name4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine
PubChem CID11230678
Molecular FormulaC10H5Cl2FN2O
Molecular Weight259.07 g/mol
Exact Mass257.98
IUPAC Name4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine
SMILESFc1c(Cl)ncnc1Oc1ccccc1Cl
InChIInChI=1S/C10H5Cl2FN2O/c11-6-3-1-2-4-7(6)16-10-8(13)9(12)14-5-15-10/h1-5H
InChIKeyRGBIKVOIODUDLX-UHFFFAOYSA-N
XLogP3.71
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.07
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine?
The IUPAC name of 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine (CID 11230678) is 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine.
What is the SMILES notation for 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine?
The canonical SMILES for 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine is Fc1c(Cl)ncnc1Oc1ccccc1Cl.
What is the InChIKey of 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine?
The InChIKey is RGBIKVOIODUDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2FN2O/c11-6-3-1-2-4-7(6)16-10-8(13)9(12)14-5-15-10/h1-5H.
What are the key properties of 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine?
4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine has a molecular weight of 259.07 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(2-chlorophenoxy)-5-fluoropyrimidine is sourced from PubChem (CID 11230678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).