4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine

C12H6F2N2O2 — CID 90645339

IUPAC4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine
SMILESFc1ccc(Oc2ncnc3ccoc23)c(F)c1
InChIInChI=1S/C12H6F2N2O2/c13-7-1-2-10(8(14)5-7)18-12-11-9(3-4-17-11)15-6-16-12/h1-6H
InChIKeyMTEWLPMHHSKPNV-UHFFFAOYSA-N
MW248.19 g/mol
LogP3.29
Rot. Bonds2

About 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine

4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine (PubChem CID 90645339) has the molecular formula C12H6F2N2O2 and a molecular weight of 248.19 g/mol. Its IUPAC name is 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine.

Molecular Properties

Compound Name4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine
PubChem CID90645339
Molecular FormulaC12H6F2N2O2
Molecular Weight248.19 g/mol
Exact Mass248.04
IUPAC Name4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine
SMILESFc1ccc(Oc2ncnc3ccoc23)c(F)c1
InChIInChI=1S/C12H6F2N2O2/c13-7-1-2-10(8(14)5-7)18-12-11-9(3-4-17-11)15-6-16-12/h1-6H
InChIKeyMTEWLPMHHSKPNV-UHFFFAOYSA-N
XLogP3.29
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.19
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine?
The IUPAC name of 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine (CID 90645339) is 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine.
What is the SMILES notation for 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine?
The canonical SMILES for 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine is Fc1ccc(Oc2ncnc3ccoc23)c(F)c1.
What is the InChIKey of 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine?
The InChIKey is MTEWLPMHHSKPNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F2N2O2/c13-7-1-2-10(8(14)5-7)18-12-11-9(3-4-17-11)15-6-16-12/h1-6H.
What are the key properties of 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine?
4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine has a molecular weight of 248.19 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenoxy)furo[3,2-d]pyrimidine is sourced from PubChem (CID 90645339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).