2-phenyl-3-pyridin-3-ylquinazolin-4-one

C19H13N3O — CID 921163

IUPAC2-phenyl-3-pyridin-3-ylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccccc2)n1-c1cccnc1
InChIInChI=1S/C19H13N3O/c23-19-16-10-4-5-11-17(16)21-18(14-7-2-1-3-8-14)22(19)15-9-6-12-20-13-15/h1-13H
InChIKeyMDBVLXFPWBTODC-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.45
Rot. Bonds2

About 2-phenyl-3-pyridin-3-ylquinazolin-4-one

2-phenyl-3-pyridin-3-ylquinazolin-4-one (PubChem CID 921163) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-phenyl-3-pyridin-3-ylquinazolin-4-one.

Molecular Properties

Compound Name2-phenyl-3-pyridin-3-ylquinazolin-4-one
PubChem CID921163
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name2-phenyl-3-pyridin-3-ylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccccc2)n1-c1cccnc1
InChIInChI=1S/C19H13N3O/c23-19-16-10-4-5-11-17(16)21-18(14-7-2-1-3-8-14)22(19)15-9-6-12-20-13-15/h1-13H
InChIKeyMDBVLXFPWBTODC-UHFFFAOYSA-N
XLogP3.45
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-pyridin-3-ylquinazolin-4-one?
The IUPAC name of 2-phenyl-3-pyridin-3-ylquinazolin-4-one (CID 921163) is 2-phenyl-3-pyridin-3-ylquinazolin-4-one.
What is the SMILES notation for 2-phenyl-3-pyridin-3-ylquinazolin-4-one?
The canonical SMILES for 2-phenyl-3-pyridin-3-ylquinazolin-4-one is O=c1c2ccccc2nc(-c2ccccc2)n1-c1cccnc1.
What is the InChIKey of 2-phenyl-3-pyridin-3-ylquinazolin-4-one?
The InChIKey is MDBVLXFPWBTODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c23-19-16-10-4-5-11-17(16)21-18(14-7-2-1-3-8-14)22(19)15-9-6-12-20-13-15/h1-13H.
What are the key properties of 2-phenyl-3-pyridin-3-ylquinazolin-4-one?
2-phenyl-3-pyridin-3-ylquinazolin-4-one has a molecular weight of 299.33 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-pyridin-3-ylquinazolin-4-one is sourced from PubChem (CID 921163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).