2,4-bis(furan-3-yl)pyrimidine

C12H8N2O2 — CID 46172976

IUPAC2,4-bis(furan-3-yl)pyrimidine
SMILESc1cc(-c2ccoc2)nc(-c2ccoc2)n1
InChIInChI=1S/C12H8N2O2/c1-4-13-12(10-3-6-16-8-10)14-11(1)9-2-5-15-7-9/h1-8H
InChIKeySJOPNSLWFHJUEC-UHFFFAOYSA-N
MW212.21 g/mol
LogP3.00
Rot. Bonds2

About 2,4-bis(furan-3-yl)pyrimidine

2,4-bis(furan-3-yl)pyrimidine (PubChem CID 46172976) has the molecular formula C12H8N2O2 and a molecular weight of 212.21 g/mol. Its IUPAC name is 2,4-bis(furan-3-yl)pyrimidine.

Molecular Properties

Compound Name2,4-bis(furan-3-yl)pyrimidine
PubChem CID46172976
Molecular FormulaC12H8N2O2
Molecular Weight212.21 g/mol
Exact Mass212.06
IUPAC Name2,4-bis(furan-3-yl)pyrimidine
SMILESc1cc(-c2ccoc2)nc(-c2ccoc2)n1
InChIInChI=1S/C12H8N2O2/c1-4-13-12(10-3-6-16-8-10)14-11(1)9-2-5-15-7-9/h1-8H
InChIKeySJOPNSLWFHJUEC-UHFFFAOYSA-N
XLogP3.00
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-bis(furan-3-yl)pyrimidine?
The IUPAC name of 2,4-bis(furan-3-yl)pyrimidine (CID 46172976) is 2,4-bis(furan-3-yl)pyrimidine.
What is the SMILES notation for 2,4-bis(furan-3-yl)pyrimidine?
The canonical SMILES for 2,4-bis(furan-3-yl)pyrimidine is c1cc(-c2ccoc2)nc(-c2ccoc2)n1.
What is the InChIKey of 2,4-bis(furan-3-yl)pyrimidine?
The InChIKey is SJOPNSLWFHJUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O2/c1-4-13-12(10-3-6-16-8-10)14-11(1)9-2-5-15-7-9/h1-8H.
What are the key properties of 2,4-bis(furan-3-yl)pyrimidine?
2,4-bis(furan-3-yl)pyrimidine has a molecular weight of 212.21 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(furan-3-yl)pyrimidine is sourced from PubChem (CID 46172976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).