4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione

C14H20N2O4 — CID 119105822

IUPAC4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione
SMILESC=CCCC(=O)N1CCC(N2C(=O)COCC2=O)CC1
InChIInChI=1S/C14H20N2O4/c1-2-3-4-12(17)15-7-5-11(6-8-15)16-13(18)9-20-10-14(16)19/h2,11H,1,3-10H2
InChIKeyMYWGIQSTDRIEQZ-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.33
Rot. Bonds4

About 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione

4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione (PubChem CID 119105822) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione.

Molecular Properties

Compound Name4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione
PubChem CID119105822
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione
SMILESC=CCCC(=O)N1CCC(N2C(=O)COCC2=O)CC1
InChIInChI=1S/C14H20N2O4/c1-2-3-4-12(17)15-7-5-11(6-8-15)16-13(18)9-20-10-14(16)19/h2,11H,1,3-10H2
InChIKeyMYWGIQSTDRIEQZ-UHFFFAOYSA-N
XLogP0.33
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione?
The IUPAC name of 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione (CID 119105822) is 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione.
What is the SMILES notation for 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione?
The canonical SMILES for 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione is C=CCCC(=O)N1CCC(N2C(=O)COCC2=O)CC1.
What is the InChIKey of 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione?
The InChIKey is MYWGIQSTDRIEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-2-3-4-12(17)15-7-5-11(6-8-15)16-13(18)9-20-10-14(16)19/h2,11H,1,3-10H2.
What are the key properties of 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione?
4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione has a molecular weight of 280.32 g/mol, XLogP of 0.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-pent-4-enoylpiperidin-4-yl)morpholine-3,5-dione is sourced from PubChem (CID 119105822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).