2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine

C17H12N4O — CID 50963722

IUPAC2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine
SMILESc1ccc(-c2[nH]cnc2-c2cnc(-c3ccco3)nc2)cc1
InChIInChI=1S/C17H12N4O/c1-2-5-12(6-3-1)15-16(21-11-20-15)13-9-18-17(19-10-13)14-7-4-8-22-14/h1-11H,(H,20,21)
InChIKeyRXXJUWPFBAWQPG-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.79
Rot. Bonds3

About 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine

2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine (PubChem CID 50963722) has the molecular formula C17H12N4O and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine.

Molecular Properties

Compound Name2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine
PubChem CID50963722
Molecular FormulaC17H12N4O
Molecular Weight288.31 g/mol
Exact Mass288.10
IUPAC Name2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine
SMILESc1ccc(-c2[nH]cnc2-c2cnc(-c3ccco3)nc2)cc1
InChIInChI=1S/C17H12N4O/c1-2-5-12(6-3-1)15-16(21-11-20-15)13-9-18-17(19-10-13)14-7-4-8-22-14/h1-11H,(H,20,21)
InChIKeyRXXJUWPFBAWQPG-UHFFFAOYSA-N
XLogP3.79
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-phenyl-1H-imidazol-4-yl)quinoline
CID 50948318
2-(furan-2-yl)-7H-purine
CID 69436374
4-(furan-2-yl)-2-phenylpyrimidine-5-carbonitrile
CID 24901796
5-(furan-2-yl)-1H-pyrimidin-2-one
CID 53222218
[2-(furan-2-yl)pyrimidin-5-yl]hydrazine
CID 134693283
2-(furan-2-yl)-1,3,5-triazine
CID 54453407
5-(furan-2-yl)-3-methyl-2-phenyl-1H-pyrrole
CID 134968569
ethane;2-phenylfuran
CID 143157762
2-methyl-5-(4-phenyl-1H-imidazol-5-yl)-1H-imidazole
CID 50984124
5-bromo-2-(furan-2-yl)-N-methyl-6-phenylpyrimidin-4-amine
CID 66294315
4-(furan-2-yl)-5-phenylpyrimidin-2-amine
CID 134140522
4,5,6-trifluoro-2-(furan-2-yl)pyrimidine
CID 164652179

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine?
The IUPAC name of 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine (CID 50963722) is 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine.
What is the SMILES notation for 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine?
The canonical SMILES for 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine is c1ccc(-c2[nH]cnc2-c2cnc(-c3ccco3)nc2)cc1.
What is the InChIKey of 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine?
The InChIKey is RXXJUWPFBAWQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O/c1-2-5-12(6-3-1)15-16(21-11-20-15)13-9-18-17(19-10-13)14-7-4-8-22-14/h1-11H,(H,20,21).
What are the key properties of 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine?
2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine has a molecular weight of 288.31 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine is sourced from PubChem (CID 50963722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).