8-ethoxy-1H-quinazoline-2,4-dione

C10H10N2O3 — CID 19604239

IUPAC8-ethoxy-1H-quinazoline-2,4-dione
SMILESCCOc1cccc2c(=O)[nH]c(=O)[nH]c12
InChIInChI=1S/C10H10N2O3/c1-2-15-7-5-3-4-6-8(7)11-10(14)12-9(6)13/h3-5H,2H2,1H3,(H2,11,12,13,14)
InChIKeyBIBHKBCPICAQQA-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.62
Rot. Bonds2

About 8-ethoxy-1H-quinazoline-2,4-dione

8-ethoxy-1H-quinazoline-2,4-dione (PubChem CID 19604239) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 8-ethoxy-1H-quinazoline-2,4-dione.

Molecular Properties

Compound Name8-ethoxy-1H-quinazoline-2,4-dione
PubChem CID19604239
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name8-ethoxy-1H-quinazoline-2,4-dione
SMILESCCOc1cccc2c(=O)[nH]c(=O)[nH]c12
InChIInChI=1S/C10H10N2O3/c1-2-15-7-5-3-4-6-8(7)11-10(14)12-9(6)13/h3-5H,2H2,1H3,(H2,11,12,13,14)
InChIKeyBIBHKBCPICAQQA-UHFFFAOYSA-N
XLogP0.62
TPSA74.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-ethoxy-1H-quinazoline-2,4-dione?
The IUPAC name of 8-ethoxy-1H-quinazoline-2,4-dione (CID 19604239) is 8-ethoxy-1H-quinazoline-2,4-dione.
What is the SMILES notation for 8-ethoxy-1H-quinazoline-2,4-dione?
The canonical SMILES for 8-ethoxy-1H-quinazoline-2,4-dione is CCOc1cccc2c(=O)[nH]c(=O)[nH]c12.
What is the InChIKey of 8-ethoxy-1H-quinazoline-2,4-dione?
The InChIKey is BIBHKBCPICAQQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-2-15-7-5-3-4-6-8(7)11-10(14)12-9(6)13/h3-5H,2H2,1H3,(H2,11,12,13,14).
What are the key properties of 8-ethoxy-1H-quinazoline-2,4-dione?
8-ethoxy-1H-quinazoline-2,4-dione has a molecular weight of 206.20 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethoxy-1H-quinazoline-2,4-dione is sourced from PubChem (CID 19604239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).