(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one

C10H15NO2 — CID 144547297

IUPAC(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one
SMILESC/C=C1/CN(C)C(=O)O/C1=C/CC
InChIInChI=1S/C10H15NO2/c1-4-6-9-8(5-2)7-11(3)10(12)13-9/h5-6H,4,7H2,1-3H3/b8-5-,9-6+
InChIKeyOOIUEBOIDBTBJL-LDFAFZTOSA-N
MW181.23 g/mol
LogP2.31
Rot. Bonds1

About (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one

(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one (PubChem CID 144547297) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one.

Molecular Properties

Compound Name(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one
PubChem CID144547297
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one
SMILESC/C=C1/CN(C)C(=O)O/C1=C/CC
InChIInChI=1S/C10H15NO2/c1-4-6-9-8(5-2)7-11(3)10(12)13-9/h5-6H,4,7H2,1-3H3/b8-5-,9-6+
InChIKeyOOIUEBOIDBTBJL-LDFAFZTOSA-N
XLogP2.31
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4E,5E)-4-ethylidene-5-propylidene-1,3-dioxolane
CID 88980689
(3E,4E)-3-ethylidene-1-methyl-4-propylidenepyrrolidine-2,5-dione
CID 130413151
(2E,3Z)-2-ethylidene-3-propylideneoxolane
CID 142121655
ethane;(3E,4E)-3-ethylidene-1-methyl-4-prop-2-enylidenepyrrolidin-2-one
CID 171627448
(3E)-5-methyl-3-propylideneoxolan-2-one
CID 10820611
(2E)-4-hydroxy-5-methyl-2-propylidenefuran-3-one
CID 25244172
(3E,4E)-3-ethylidene-4-propylidenepyrrolidin-2-one
CID 170059513
(4E)-1,2-dimethyl-5-methylidene-4-propylidenepiperidin-3-one
CID 142881457
1,2-di(ethylidene)cyclopropane
CID 123857340
ethane;(1Z,2Z)-1-ethylidene-2-propylidenecyclopentane;fluoromethane
CID 142105046
(4E,5Z)-5-(aminomethylidene)-4-ethylidene-1-methyl-1,3-diazinan-2-one;ethane
CID 143228257
(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane
CID 142123041

Frequently Asked Questions

What is the IUPAC name of (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one?
The IUPAC name of (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one (CID 144547297) is (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one.
What is the SMILES notation for (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one?
The canonical SMILES for (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one is C/C=C1/CN(C)C(=O)O/C1=C/CC.
What is the InChIKey of (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one?
The InChIKey is OOIUEBOIDBTBJL-LDFAFZTOSA-N. The full InChI is InChI=1S/C10H15NO2/c1-4-6-9-8(5-2)7-11(3)10(12)13-9/h5-6H,4,7H2,1-3H3/b8-5-,9-6+.
What are the key properties of (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one?
(5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one has a molecular weight of 181.23 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6E)-5-ethylidene-3-methyl-6-propylidene-1,3-oxazinan-2-one is sourced from PubChem (CID 144547297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).