2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one

C20H16N2O2 — CID 683379

IUPAC2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccco2)n1CCc1ccccc1
InChIInChI=1S/C20H16N2O2/c23-20-16-9-4-5-10-17(16)21-19(18-11-6-14-24-18)22(20)13-12-15-7-2-1-3-8-15/h1-11,14H,12-13H2
InChIKeyZFIMKOHGGKYLGR-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.90
Rot. Bonds4

About 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one

2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one (PubChem CID 683379) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one
PubChem CID683379
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccco2)n1CCc1ccccc1
InChIInChI=1S/C20H16N2O2/c23-20-16-9-4-5-10-17(16)21-19(18-11-6-14-24-18)22(20)13-12-15-7-2-1-3-8-15/h1-11,14H,12-13H2
InChIKeyZFIMKOHGGKYLGR-UHFFFAOYSA-N
XLogP3.90
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one?
The IUPAC name of 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one (CID 683379) is 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one.
What is the SMILES notation for 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one?
The canonical SMILES for 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one is O=c1c2ccccc2nc(-c2ccco2)n1CCc1ccccc1.
What is the InChIKey of 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one?
The InChIKey is ZFIMKOHGGKYLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-20-16-9-4-5-10-17(16)21-19(18-11-6-14-24-18)22(20)13-12-15-7-2-1-3-8-15/h1-11,14H,12-13H2.
What are the key properties of 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one?
2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one has a molecular weight of 316.36 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-3-(2-phenylethyl)quinazolin-4-one is sourced from PubChem (CID 683379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).