5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one

C24H23N3O — CID 144954508

IUPAC5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one
SMILESCCc1nc2cccc(-c3cccc(N(C)C)c3)c2c(=O)n1-c1ccccc1
InChIInChI=1S/C24H23N3O/c1-4-22-25-21-15-9-14-20(17-10-8-13-19(16-17)26(2)3)23(21)24(28)27(22)18-11-6-5-7-12-18/h5-16H,4H2,1-3H3
InChIKeyHTPPDUCVCTWRSA-UHFFFAOYSA-N
MW369.47 g/mol
LogP4.68
Rot. Bonds4

About 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one

5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one (PubChem CID 144954508) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one
PubChem CID144954508
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC Name5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one
SMILESCCc1nc2cccc(-c3cccc(N(C)C)c3)c2c(=O)n1-c1ccccc1
InChIInChI=1S/C24H23N3O/c1-4-22-25-21-15-9-14-20(17-10-8-13-19(16-17)26(2)3)23(21)24(28)27(22)18-11-6-5-7-12-18/h5-16H,4H2,1-3H3
InChIKeyHTPPDUCVCTWRSA-UHFFFAOYSA-N
XLogP4.68
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-3-phenyl-5-[5-(trifluoromethyl)-3-pyridinyl]quinazolin-4-one
CID 144954674
2-ethyl-4-oxo-3-phenylquinazoline-5-carbonitrile
CID 123768528
2-ethyl-3-phenylquinazolin-4-one
CID 719985
5-but-1-ynyl-2-ethyl-3-phenylquinazolin-4-one
CID 144824418
2,4-diaminopyrimidine-5-carbonitrile;2-ethyl-5-(4-methylphenyl)-3-phenylquinazolin-4-one
CID 144954835
5-[2-(1,3-dimethylpyrazol-4-yl)ethynyl]-2-ethyl-3-phenylquinazolin-4-one
CID 144824894
2-ethyl-5-[(E)-2-(1-methylpyrazol-3-yl)ethenyl]-3-phenylquinazolin-4-one
CID 144824650
3-[3-(dimethylamino)phenyl]-2-methylquinazolin-4-one
CID 3031710
8-(3-chlorophenyl)-3-ethyl-2-phenylisoquinolin-1-one
CID 71291771
5-[2-(1,5-dimethylpyrazol-4-yl)ethynyl]-2-ethyl-3-phenylquinazolin-4-one
CID 123948593
5-(5-methoxy-3-pyridinyl)-3-phenyl-2-(propylaminomethyl)quinazolin-4-one
CID 144779762
5-bromo-3-phenyl-2-propylquinazolin-4-one
CID 142506267

Frequently Asked Questions

What is the IUPAC name of 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one?
The IUPAC name of 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one (CID 144954508) is 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one.
What is the SMILES notation for 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one?
The canonical SMILES for 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one is CCc1nc2cccc(-c3cccc(N(C)C)c3)c2c(=O)n1-c1ccccc1.
What is the InChIKey of 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one?
The InChIKey is HTPPDUCVCTWRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-4-22-25-21-15-9-14-20(17-10-8-13-19(16-17)26(2)3)23(21)24(28)27(22)18-11-6-5-7-12-18/h5-16H,4H2,1-3H3.
What are the key properties of 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one?
5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one has a molecular weight of 369.47 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(dimethylamino)phenyl]-2-ethyl-3-phenylquinazolin-4-one is sourced from PubChem (CID 144954508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).