4-(2,4-difluorophenoxy)pyrimidine

C10H6F2N2O — CID 90645336

IUPAC4-(2,4-difluorophenoxy)pyrimidine
SMILESFc1ccc(Oc2ccncn2)c(F)c1
InChIInChI=1S/C10H6F2N2O/c11-7-1-2-9(8(12)5-7)15-10-3-4-13-6-14-10/h1-6H
InChIKeyJVXUZJALANFOHZ-UHFFFAOYSA-N
MW208.17 g/mol
LogP2.55
Rot. Bonds2

About 4-(2,4-difluorophenoxy)pyrimidine

4-(2,4-difluorophenoxy)pyrimidine (PubChem CID 90645336) has the molecular formula C10H6F2N2O and a molecular weight of 208.17 g/mol. Its IUPAC name is 4-(2,4-difluorophenoxy)pyrimidine.

Molecular Properties

Compound Name4-(2,4-difluorophenoxy)pyrimidine
PubChem CID90645336
Molecular FormulaC10H6F2N2O
Molecular Weight208.17 g/mol
Exact Mass208.04
IUPAC Name4-(2,4-difluorophenoxy)pyrimidine
SMILESFc1ccc(Oc2ccncn2)c(F)c1
InChIInChI=1S/C10H6F2N2O/c11-7-1-2-9(8(12)5-7)15-10-3-4-13-6-14-10/h1-6H
InChIKeyJVXUZJALANFOHZ-UHFFFAOYSA-N
XLogP2.55
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.17
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenoxy)pyrimidine?
The IUPAC name of 4-(2,4-difluorophenoxy)pyrimidine (CID 90645336) is 4-(2,4-difluorophenoxy)pyrimidine.
What is the SMILES notation for 4-(2,4-difluorophenoxy)pyrimidine?
The canonical SMILES for 4-(2,4-difluorophenoxy)pyrimidine is Fc1ccc(Oc2ccncn2)c(F)c1.
What is the InChIKey of 4-(2,4-difluorophenoxy)pyrimidine?
The InChIKey is JVXUZJALANFOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F2N2O/c11-7-1-2-9(8(12)5-7)15-10-3-4-13-6-14-10/h1-6H.
What are the key properties of 4-(2,4-difluorophenoxy)pyrimidine?
4-(2,4-difluorophenoxy)pyrimidine has a molecular weight of 208.17 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenoxy)pyrimidine is sourced from PubChem (CID 90645336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).