3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one

C19H20N4O2 — CID 2813225

IUPAC3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one
SMILESO=C1NCCN1CCN1C(=O)c2ccccc2NC1c1ccccc1
InChIInChI=1S/C19H20N4O2/c24-18-15-8-4-5-9-16(15)21-17(14-6-2-1-3-7-14)23(18)13-12-22-11-10-20-19(22)25/h1-9,17,21H,10-13H2,(H,20,25)
InChIKeyLUAWGLIKPCKEHB-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.28
Rot. Bonds4

About 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one

3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one (PubChem CID 2813225) has the molecular formula C19H20N4O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one.

Molecular Properties

Compound Name3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one
PubChem CID2813225
Molecular FormulaC19H20N4O2
Molecular Weight336.39 g/mol
Exact Mass336.16
IUPAC Name3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one
SMILESO=C1NCCN1CCN1C(=O)c2ccccc2NC1c1ccccc1
InChIInChI=1S/C19H20N4O2/c24-18-15-8-4-5-9-16(15)21-17(14-6-2-1-3-7-14)23(18)13-12-22-11-10-20-19(22)25/h1-9,17,21H,10-13H2,(H,20,25)
InChIKeyLUAWGLIKPCKEHB-UHFFFAOYSA-N
XLogP2.28
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one?
The IUPAC name of 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one (CID 2813225) is 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one.
What is the SMILES notation for 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one?
The canonical SMILES for 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one is O=C1NCCN1CCN1C(=O)c2ccccc2NC1c1ccccc1.
What is the InChIKey of 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one?
The InChIKey is LUAWGLIKPCKEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-18-15-8-4-5-9-16(15)21-17(14-6-2-1-3-7-14)23(18)13-12-22-11-10-20-19(22)25/h1-9,17,21H,10-13H2,(H,20,25).
What are the key properties of 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one?
3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one has a molecular weight of 336.39 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-phenyl-1,2-dihydroquinazolin-4-one is sourced from PubChem (CID 2813225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).