5-(2-methoxyethyl)-1H-quinazoline-2,4-dione

C11H12N2O3 — CID 140789794

IUPAC5-(2-methoxyethyl)-1H-quinazoline-2,4-dione
SMILESCOCCc1cccc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C11H12N2O3/c1-16-6-5-7-3-2-4-8-9(7)10(14)13-11(15)12-8/h2-4H,5-6H2,1H3,(H2,12,13,14,15)
InChIKeyFJZOQKYXHAFOHZ-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.41
Rot. Bonds3

About 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione

5-(2-methoxyethyl)-1H-quinazoline-2,4-dione (PubChem CID 140789794) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione.

Molecular Properties

Compound Name5-(2-methoxyethyl)-1H-quinazoline-2,4-dione
PubChem CID140789794
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name5-(2-methoxyethyl)-1H-quinazoline-2,4-dione
SMILESCOCCc1cccc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C11H12N2O3/c1-16-6-5-7-3-2-4-8-9(7)10(14)13-11(15)12-8/h2-4H,5-6H2,1H3,(H2,12,13,14,15)
InChIKeyFJZOQKYXHAFOHZ-UHFFFAOYSA-N
XLogP0.41
TPSA74.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione?
The IUPAC name of 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione (CID 140789794) is 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione.
What is the SMILES notation for 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione?
The canonical SMILES for 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione is COCCc1cccc2[nH]c(=O)[nH]c(=O)c12.
What is the InChIKey of 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione?
The InChIKey is FJZOQKYXHAFOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c1-16-6-5-7-3-2-4-8-9(7)10(14)13-11(15)12-8/h2-4H,5-6H2,1H3,(H2,12,13,14,15).
What are the key properties of 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione?
5-(2-methoxyethyl)-1H-quinazoline-2,4-dione has a molecular weight of 220.23 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethyl)-1H-quinazoline-2,4-dione is sourced from PubChem (CID 140789794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).