2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol

C19H14N2O2 — CID 175398744

IUPAC2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol
SMILESOc1ccccc1-c1cocc1-c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C19H14N2O2/c22-19-4-2-1-3-16(19)18-12-23-11-17(18)14-5-7-15(8-6-14)21-10-9-20-13-21/h1-13,22H
InChIKeyACCZQXMOLSAXGG-UHFFFAOYSA-N
MW302.33 g/mol
LogP4.50
Rot. Bonds3

About 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol

2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol (PubChem CID 175398744) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol.

Molecular Properties

Compound Name2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol
PubChem CID175398744
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol
SMILESOc1ccccc1-c1cocc1-c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C19H14N2O2/c22-19-4-2-1-3-16(19)18-12-23-11-17(18)14-5-7-15(8-6-14)21-10-9-20-13-21/h1-13,22H
InChIKeyACCZQXMOLSAXGG-UHFFFAOYSA-N
XLogP4.50
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol?
The IUPAC name of 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol (CID 175398744) is 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol.
What is the SMILES notation for 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol?
The canonical SMILES for 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol is Oc1ccccc1-c1cocc1-c1ccc(-n2ccnc2)cc1.
What is the InChIKey of 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol?
The InChIKey is ACCZQXMOLSAXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c22-19-4-2-1-3-16(19)18-12-23-11-17(18)14-5-7-15(8-6-14)21-10-9-20-13-21/h1-13,22H.
What are the key properties of 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol?
2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol has a molecular weight of 302.33 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-imidazol-1-ylphenyl)furan-3-yl]phenol is sourced from PubChem (CID 175398744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).