4-(furan-2-yl)-5-phenylpyrimidine

C14H10N2O — CID 127052159

IUPAC4-(furan-2-yl)-5-phenylpyrimidine
SMILESc1ccc(-c2cncnc2-c2ccco2)cc1
InChIInChI=1S/C14H10N2O/c1-2-5-11(6-3-1)12-9-15-10-16-14(12)13-7-4-8-17-13/h1-10H
InChIKeySFAPHXXWAGXMHQ-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.40
Rot. Bonds2

About 4-(furan-2-yl)-5-phenylpyrimidine

4-(furan-2-yl)-5-phenylpyrimidine (PubChem CID 127052159) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 4-(furan-2-yl)-5-phenylpyrimidine.

Molecular Properties

Compound Name4-(furan-2-yl)-5-phenylpyrimidine
PubChem CID127052159
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name4-(furan-2-yl)-5-phenylpyrimidine
SMILESc1ccc(-c2cncnc2-c2ccco2)cc1
InChIInChI=1S/C14H10N2O/c1-2-5-11(6-3-1)12-9-15-10-16-14(12)13-7-4-8-17-13/h1-10H
InChIKeySFAPHXXWAGXMHQ-UHFFFAOYSA-N
XLogP3.40
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(furan-2-yl)-5-phenylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-5-phenylpyrimidine?
The IUPAC name of 4-(furan-2-yl)-5-phenylpyrimidine (CID 127052159) is 4-(furan-2-yl)-5-phenylpyrimidine.
What is the SMILES notation for 4-(furan-2-yl)-5-phenylpyrimidine?
The canonical SMILES for 4-(furan-2-yl)-5-phenylpyrimidine is c1ccc(-c2cncnc2-c2ccco2)cc1.
What is the InChIKey of 4-(furan-2-yl)-5-phenylpyrimidine?
The InChIKey is SFAPHXXWAGXMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c1-2-5-11(6-3-1)12-9-15-10-16-14(12)13-7-4-8-17-13/h1-10H.
What are the key properties of 4-(furan-2-yl)-5-phenylpyrimidine?
4-(furan-2-yl)-5-phenylpyrimidine has a molecular weight of 222.25 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-5-phenylpyrimidine is sourced from PubChem (CID 127052159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).