2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one

C11H14N2O2 — CID 123444466

IUPAC2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one
SMILESCC=c1nc2n(c(=O)c1=CC)CCOC2
InChIInChI=1S/C11H14N2O2/c1-3-8-9(4-2)12-10-7-15-6-5-13(10)11(8)14/h3-4H,5-7H2,1-2H3
InChIKeyOKQTYVKMATYHLE-UHFFFAOYSA-N
MW206.25 g/mol
LogP-0.63
Rot. Bonds

About 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one

2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one (PubChem CID 123444466) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one.

Molecular Properties

Compound Name2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one
PubChem CID123444466
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one
SMILESCC=c1nc2n(c(=O)c1=CC)CCOC2
InChIInChI=1S/C11H14N2O2/c1-3-8-9(4-2)12-10-7-15-6-5-13(10)11(8)14/h3-4H,5-7H2,1-2H3
InChIKeyOKQTYVKMATYHLE-UHFFFAOYSA-N
XLogP-0.63
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 5-0.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one
CID 140511865
[2-[(3E)-3,6-dimethylhepta-1,3,5-trien-2-yl]imino-1,6-dimethyl-4-pyridinyl]-morpholin-4-ylmethanone;ethane
CID 142146547
2-methyl-6-morpholinopyrido[4,3-d]pyrimidine-4,7(3H,6H)-dione
CID 164555162
2-methyl-6-morpholin-2-yl-3H-pyrido[4,3-d]pyrimidine-4,7-dione
CID 175574528
[2-[(3E)-3,6-dimethylhepta-1,3,5-trien-2-yl]imino-1,6-dimethyl-4-pyridinyl]-morpholin-4-ylmethanone
CID 142146548

Frequently Asked Questions

What is the IUPAC name of 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one?
The IUPAC name of 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one (CID 123444466) is 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one.
What is the SMILES notation for 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one?
The canonical SMILES for 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one is CC=c1nc2n(c(=O)c1=CC)CCOC2.
What is the InChIKey of 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one?
The InChIKey is OKQTYVKMATYHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-3-8-9(4-2)12-10-7-15-6-5-13(10)11(8)14/h3-4H,5-7H2,1-2H3.
What are the key properties of 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one?
2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one has a molecular weight of 206.25 g/mol, XLogP of -0.63, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(ethylidene)-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazin-4-one is sourced from PubChem (CID 123444466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).