4-(5-phenoxyfuran-2-yl)pyrimidine

C14H10N2O2 — CID 155920355

IUPAC4-(5-phenoxyfuran-2-yl)pyrimidine
SMILESc1ccc(Oc2ccc(-c3ccncn3)o2)cc1
InChIInChI=1S/C14H10N2O2/c1-2-4-11(5-3-1)17-14-7-6-13(18-14)12-8-9-15-10-16-12/h1-10H
InChIKeyIXWONBGJXMFHEE-UHFFFAOYSA-N
MW238.25 g/mol
LogP3.53
Rot. Bonds3

About 4-(5-phenoxyfuran-2-yl)pyrimidine

4-(5-phenoxyfuran-2-yl)pyrimidine (PubChem CID 155920355) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 4-(5-phenoxyfuran-2-yl)pyrimidine.

Molecular Properties

Compound Name4-(5-phenoxyfuran-2-yl)pyrimidine
PubChem CID155920355
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name4-(5-phenoxyfuran-2-yl)pyrimidine
SMILESc1ccc(Oc2ccc(-c3ccncn3)o2)cc1
InChIInChI=1S/C14H10N2O2/c1-2-4-11(5-3-1)17-14-7-6-13(18-14)12-8-9-15-10-16-12/h1-10H
InChIKeyIXWONBGJXMFHEE-UHFFFAOYSA-N
XLogP3.53
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5-phenoxyfuran-2-yl)pyrimidine?
The IUPAC name of 4-(5-phenoxyfuran-2-yl)pyrimidine (CID 155920355) is 4-(5-phenoxyfuran-2-yl)pyrimidine.
What is the SMILES notation for 4-(5-phenoxyfuran-2-yl)pyrimidine?
The canonical SMILES for 4-(5-phenoxyfuran-2-yl)pyrimidine is c1ccc(Oc2ccc(-c3ccncn3)o2)cc1.
What is the InChIKey of 4-(5-phenoxyfuran-2-yl)pyrimidine?
The InChIKey is IXWONBGJXMFHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c1-2-4-11(5-3-1)17-14-7-6-13(18-14)12-8-9-15-10-16-12/h1-10H.
What are the key properties of 4-(5-phenoxyfuran-2-yl)pyrimidine?
4-(5-phenoxyfuran-2-yl)pyrimidine has a molecular weight of 238.25 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-phenoxyfuran-2-yl)pyrimidine is sourced from PubChem (CID 155920355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).