3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione

C16H22N4O6 — CID 72845068

IUPAC3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione
SMILESCCc1nc(CC2CN(C(=O)CN3C(=O)OC(C)(C)C3=O)CCO2)no1
InChIInChI=1S/C16H22N4O6/c1-4-12-17-11(18-26-12)7-10-8-19(5-6-24-10)13(21)9-20-14(22)16(2,3)25-15(20)23/h10H,4-9H2,1-3H3
InChIKeyRHMXBKFVRLSQQM-UHFFFAOYSA-N
MW366.37 g/mol
LogP0.16
Rot. Bonds5

About 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione

3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione (PubChem CID 72845068) has the molecular formula C16H22N4O6 and a molecular weight of 366.37 g/mol. Its IUPAC name is 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione
PubChem CID72845068
Molecular FormulaC16H22N4O6
Molecular Weight366.37 g/mol
Exact Mass366.15
IUPAC Name3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione
SMILESCCc1nc(CC2CN(C(=O)CN3C(=O)OC(C)(C)C3=O)CCO2)no1
InChIInChI=1S/C16H22N4O6/c1-4-12-17-11(18-26-12)7-10-8-19(5-6-24-10)13(21)9-20-14(22)16(2,3)25-15(20)23/h10H,4-9H2,1-3H3
InChIKeyRHMXBKFVRLSQQM-UHFFFAOYSA-N
XLogP0.16
TPSA115.07 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.37
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione (CID 72845068) is 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione is CCc1nc(CC2CN(C(=O)CN3C(=O)OC(C)(C)C3=O)CCO2)no1.
What is the InChIKey of 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione?
The InChIKey is RHMXBKFVRLSQQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O6/c1-4-12-17-11(18-26-12)7-10-8-19(5-6-24-10)13(21)9-20-14(22)16(2,3)25-15(20)23/h10H,4-9H2,1-3H3.
What are the key properties of 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione?
3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione has a molecular weight of 366.37 g/mol, XLogP of 0.16, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]morpholin-4-yl]-2-oxoethyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 72845068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).