5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one

C12H14N2O3S — CID 10778160

IUPAC5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one
SMILESCc1sc2nc(N3CCOCC3)oc(=O)c2c1C
InChIInChI=1S/C12H14N2O3S/c1-7-8(2)18-10-9(7)11(15)17-12(13-10)14-3-5-16-6-4-14/h3-6H2,1-2H3
InChIKeyMQWAQSFOHZXGJO-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.70
Rot. Bonds1

About 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one

5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one (PubChem CID 10778160) has the molecular formula C12H14N2O3S and a molecular weight of 266.32 g/mol. Its IUPAC name is 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one
PubChem CID10778160
Molecular FormulaC12H14N2O3S
Molecular Weight266.32 g/mol
Exact Mass266.07
IUPAC Name5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one
SMILESCc1sc2nc(N3CCOCC3)oc(=O)c2c1C
InChIInChI=1S/C12H14N2O3S/c1-7-8(2)18-10-9(7)11(15)17-12(13-10)14-3-5-16-6-4-14/h3-6H2,1-2H3
InChIKeyMQWAQSFOHZXGJO-UHFFFAOYSA-N
XLogP1.70
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one?
The IUPAC name of 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one (CID 10778160) is 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one.
What is the SMILES notation for 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one?
The canonical SMILES for 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one is Cc1sc2nc(N3CCOCC3)oc(=O)c2c1C.
What is the InChIKey of 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one?
The InChIKey is MQWAQSFOHZXGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3S/c1-7-8(2)18-10-9(7)11(15)17-12(13-10)14-3-5-16-6-4-14/h3-6H2,1-2H3.
What are the key properties of 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one?
5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one has a molecular weight of 266.32 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-2-morpholin-4-ylthieno[2,3-d][1,3]oxazin-4-one is sourced from PubChem (CID 10778160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).