5-ethylidene-4-propylidene-1,3-oxazolidin-2-one

C8H11NO2 — CID 123289178

IUPAC5-ethylidene-4-propylidene-1,3-oxazolidin-2-one
SMILESCC=c1oc(=O)[nH]c1=CCC
InChIInChI=1S/C8H11NO2/c1-3-5-6-7(4-2)11-8(10)9-6/h4-5H,3H2,1-2H3,(H,9,10)
InChIKeyYOLLBWYIDMNTLB-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.04
Rot. Bonds1

About 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one

5-ethylidene-4-propylidene-1,3-oxazolidin-2-one (PubChem CID 123289178) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-ethylidene-4-propylidene-1,3-oxazolidin-2-one
PubChem CID123289178
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name5-ethylidene-4-propylidene-1,3-oxazolidin-2-one
SMILESCC=c1oc(=O)[nH]c1=CCC
InChIInChI=1S/C8H11NO2/c1-3-5-6-7(4-2)11-8(10)9-6/h4-5H,3H2,1-2H3,(H,9,10)
InChIKeyYOLLBWYIDMNTLB-UHFFFAOYSA-N
XLogP-0.04
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Methylene-5-propylidene-2-oxazolidinone
CID 129708942
(z)-5-Ethylidene-4-methylideneoxazolidin-2-one
CID 177694473
6-methyl-5,6-dihydro-3H-1,3-benzoxazol-2-one
CID 68030197
5,6-dihydro-3H-1,3-benzoxazol-2-one
CID 69153790
(4E,5E)-5-[(E)-4,4-dimethylpent-2-enylidene]-4-ethylidene-1,3-oxazolidin-2-one
CID 71012702
(5R)-5-methyl-5,6-dihydro-3H-1,3-benzoxazol-2-one
CID 89024034
5-methyl-5,6-dihydro-3H-1,3-benzoxazol-2-one
CID 89029209
5-(dimethylamino)-5,6-dihydro-3H-1,3-benzoxazol-2-one
CID 123560061
(4E)-4-[(E)-2-hydroxybut-2-enylidene]-5-methylidene-1,3-oxazolidin-2-one
CID 134172827
(4E,5E)-5-ethylidene-4-[(Z)-2-methylbut-2-enylidene]-1,3-oxazolidin-2-one
CID 135202415
3,7-Dihydrocyclohepta[d][1,3]oxazol-2-one;ethane;molecular hydrogen
CID 142448158
7-Methyl-3,7-dihydrocyclohepta[d][1,3]oxazol-2-one;propane
CID 142969705

Frequently Asked Questions

What is the IUPAC name of 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one?
The IUPAC name of 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one (CID 123289178) is 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one?
The canonical SMILES for 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one is CC=c1oc(=O)[nH]c1=CCC.
What is the InChIKey of 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one?
The InChIKey is YOLLBWYIDMNTLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-3-5-6-7(4-2)11-8(10)9-6/h4-5H,3H2,1-2H3,(H,9,10).
What are the key properties of 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one?
5-ethylidene-4-propylidene-1,3-oxazolidin-2-one has a molecular weight of 153.18 g/mol, XLogP of -0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylidene-4-propylidene-1,3-oxazolidin-2-one is sourced from PubChem (CID 123289178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).