(4Z)-4-ethylidene-1,3-oxazolidin-2-one

C5H7NO2 — CID 90290266

IUPAC(4Z)-4-ethylidene-1,3-oxazolidin-2-one
SMILESC/C=C1/COC(=O)N1
InChIInChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2H,3H2,1H3,(H,6,7)/b4-2-
InChIKeyAZGKLSBSXKXKIV-RQOWECAXSA-N
MW113.12 g/mol
LogP0.63
Rot. Bonds

About (4Z)-4-ethylidene-1,3-oxazolidin-2-one

(4Z)-4-ethylidene-1,3-oxazolidin-2-one (PubChem CID 90290266) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is (4Z)-4-ethylidene-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4Z)-4-ethylidene-1,3-oxazolidin-2-one
PubChem CID90290266
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name(4Z)-4-ethylidene-1,3-oxazolidin-2-one
SMILESC/C=C1/COC(=O)N1
InChIInChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2H,3H2,1H3,(H,6,7)/b4-2-
InChIKeyAZGKLSBSXKXKIV-RQOWECAXSA-N
XLogP0.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-ethylidene-1,3-oxazolidin-2-one?
The IUPAC name of (4Z)-4-ethylidene-1,3-oxazolidin-2-one (CID 90290266) is (4Z)-4-ethylidene-1,3-oxazolidin-2-one.
What is the SMILES notation for (4Z)-4-ethylidene-1,3-oxazolidin-2-one?
The canonical SMILES for (4Z)-4-ethylidene-1,3-oxazolidin-2-one is C/C=C1/COC(=O)N1.
What is the InChIKey of (4Z)-4-ethylidene-1,3-oxazolidin-2-one?
The InChIKey is AZGKLSBSXKXKIV-RQOWECAXSA-N. The full InChI is InChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2H,3H2,1H3,(H,6,7)/b4-2-.
What are the key properties of (4Z)-4-ethylidene-1,3-oxazolidin-2-one?
(4Z)-4-ethylidene-1,3-oxazolidin-2-one has a molecular weight of 113.12 g/mol, XLogP of 0.63, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-ethylidene-1,3-oxazolidin-2-one is sourced from PubChem (CID 90290266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).