2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one

C10H8N2O2 — CID 726944

IUPAC2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one
SMILESO=c1c2ccccc2nc2n1CCO2
InChIInChI=1S/C10H8N2O2/c13-9-7-3-1-2-4-8(7)11-10-12(9)5-6-14-10/h1-4H,5-6H2
InChIKeyQBEBJBXQJGORQQ-UHFFFAOYSA-N
MW188.19 g/mol
LogP0.79
Rot. Bonds

About 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one

2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one (PubChem CID 726944) has the molecular formula C10H8N2O2 and a molecular weight of 188.19 g/mol. Its IUPAC name is 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one.

Molecular Properties

Compound Name2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one
PubChem CID726944
Molecular FormulaC10H8N2O2
Molecular Weight188.19 g/mol
Exact Mass188.06
IUPAC Name2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one
SMILESO=c1c2ccccc2nc2n1CCO2
InChIInChI=1S/C10H8N2O2/c13-9-7-3-1-2-4-8(7)11-10-12(9)5-6-14-10/h1-4H,5-6H2
InChIKeyQBEBJBXQJGORQQ-UHFFFAOYSA-N
XLogP0.79
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one?
The IUPAC name of 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one (CID 726944) is 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one.
What is the SMILES notation for 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one?
The canonical SMILES for 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one is O=c1c2ccccc2nc2n1CCO2.
What is the InChIKey of 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one?
The InChIKey is QBEBJBXQJGORQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2/c13-9-7-3-1-2-4-8(7)11-10-12(9)5-6-14-10/h1-4H,5-6H2.
What are the key properties of 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one?
2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one has a molecular weight of 188.19 g/mol, XLogP of 0.79, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one is sourced from PubChem (CID 726944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).