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

C18H19N3O — CID 3239245

IUPAC2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one
SMILESCN(C)CCc1nc2ccccc2c(=O)n1-c1ccccc1
InChIInChI=1S/C18H19N3O/c1-20(2)13-12-17-19-16-11-7-6-10-15(16)18(22)21(17)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKeyICUVDQSPMLGSEN-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.49
Rot. Bonds4

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

2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one (PubChem CID 3239245) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one
PubChem CID3239245
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one
SMILESCN(C)CCc1nc2ccccc2c(=O)n1-c1ccccc1
InChIInChI=1S/C18H19N3O/c1-20(2)13-12-17-19-16-11-7-6-10-15(16)18(22)21(17)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKeyICUVDQSPMLGSEN-UHFFFAOYSA-N
XLogP2.49
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(4-oxo-2-propylquinazolin-3-yl)phenyl]-2-propylquinazolin-4-one
CID 12631795
2-ethyl-3-phenylquinazolin-4-one
CID 719985
2-(4-oxo-3-phenylquinazolin-2-yl)ethylcarbamic acid
CID 122540146
2-[3-(dimethylamino)propylamino]-3-phenylquinazolin-4-one
CID 53368642
ethane;2-ethyl-3-(4-methylphenyl)quinazolin-4-one
CID 90844218
3-phenyl-2-(pyridin-1-ium-1-ylmethyl)quinazolin-4-one
CID 739394
2-(bromomethyl)-3-(4-methylphenyl)quinazolin-4-one
CID 15561402
[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]methylazanium chloride
CID 23004805
3-(dimethylamino)-2-ethylquinazolin-4-one
CID 10680290
2-[2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]isoindole-1,3-dione
CID 1366773
2-benzyl-3-(4-methoxyphenyl)quinazolin-4-one
CID 1130557
N-[4-(2-butyl-4-oxoquinazolin-3-yl)phenyl]-N-methylpyrrolidine-1-carboxamide
CID 143730756

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one?
The IUPAC name of 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one (CID 3239245) is 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one?
The canonical SMILES for 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one is CN(C)CCc1nc2ccccc2c(=O)n1-c1ccccc1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one?
The InChIKey is ICUVDQSPMLGSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-20(2)13-12-17-19-16-11-7-6-10-15(16)18(22)21(17)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3.
What are the key properties of 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one?
2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one has a molecular weight of 293.37 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl]-3-phenylquinazolin-4-one is sourced from PubChem (CID 3239245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).