3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione

C14H13N3O4 — CID 146598490

IUPAC3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
SMILESCc1nc2cccc(O)c2c(=O)n1C1CCC(=O)NC1=O
InChIInChI=1S/C14H13N3O4/c1-7-15-8-3-2-4-10(18)12(8)14(21)17(7)9-5-6-11(19)16-13(9)20/h2-4,9,18H,5-6H2,1H3,(H,16,19,20)
InChIKeyOLEWQBLUKROMKA-UHFFFAOYSA-N
MW287.27 g/mol
LogP0.39
Rot. Bonds1

About 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione

3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione (PubChem CID 146598490) has the molecular formula C14H13N3O4 and a molecular weight of 287.27 g/mol. Its IUPAC name is 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione.

Molecular Properties

Compound Name3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
PubChem CID146598490
Molecular FormulaC14H13N3O4
Molecular Weight287.27 g/mol
Exact Mass287.09
IUPAC Name3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
SMILESCc1nc2cccc(O)c2c(=O)n1C1CCC(=O)NC1=O
InChIInChI=1S/C14H13N3O4/c1-7-15-8-3-2-4-10(18)12(8)14(21)17(7)9-5-6-11(19)16-13(9)20/h2-4,9,18H,5-6H2,1H3,(H,16,19,20)
InChIKeyOLEWQBLUKROMKA-UHFFFAOYSA-N
XLogP0.39
TPSA101.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.27
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-(2-methyl-4-oxo-5-prop-1-ynylquinazolin-3-yl)piperidine-2,6-dione
CID 155178271
[3-[(3R)-2,6-dioxopiperidin-3-yl]-2-methyl-4-oxoquinazolin-5-yl]carbamoylmercury
CID 144668416
ethane;3-(2-methyl-5-nitro-4-oxoquinazolin-3-yl)piperidine-2,6-dione
CID 144585990
(3R)-3-(5-cycloheptyliodanuidyl-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
CID 164567289
4-chloro-N-[[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxoquinazolin-5-yl]methyl]benzamide
CID 24963674
3-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)azepane-2,7-dione
CID 166818482
N'-[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxoquinazolin-5-yl]-N-[2-methyl-3-(6-methylidene-2-oxopiperidin-3-yl)-4-oxoquinazolin-5-yl]decanediamide
CID 153393708
[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxoquinazolin-5-yl]methyl pyridine-2-carboxylate
CID 142699709
3-[5-methyl-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]piperidine-2,6-dione
CID 24967597
6-[[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxoquinazolin-5-yl]amino]hexyl carbamate
CID 175406178
N-[[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxoquinazolin-5-yl]methyl]-4-(fluoromethyl)benzamide
CID 66656780
(3R)-3-(5-amino-7-fluoro-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
CID 146338076

Frequently Asked Questions

What is the IUPAC name of 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione?
The IUPAC name of 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione (CID 146598490) is 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione.
What is the SMILES notation for 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione?
The canonical SMILES for 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione is Cc1nc2cccc(O)c2c(=O)n1C1CCC(=O)NC1=O.
What is the InChIKey of 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione?
The InChIKey is OLEWQBLUKROMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O4/c1-7-15-8-3-2-4-10(18)12(8)14(21)17(7)9-5-6-11(19)16-13(9)20/h2-4,9,18H,5-6H2,1H3,(H,16,19,20).
What are the key properties of 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione?
3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione has a molecular weight of 287.27 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-hydroxy-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione is sourced from PubChem (CID 146598490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).