2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate

C13H20N2O5 — CID 67361968

IUPAC2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate
SMILESCC(C)COC(=O)N1CCC(N2C(=O)COC2=O)CC1
InChIInChI=1S/C13H20N2O5/c1-9(2)7-19-12(17)14-5-3-10(4-6-14)15-11(16)8-20-13(15)18/h9-10H,3-8H2,1-2H3
InChIKeyHJSYYLULXADERX-UHFFFAOYSA-N
MW284.31 g/mol
LogP1.22
Rot. Bonds3

About 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate

2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate (PubChem CID 67361968) has the molecular formula C13H20N2O5 and a molecular weight of 284.31 g/mol. Its IUPAC name is 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate.

Molecular Properties

Compound Name2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate
PubChem CID67361968
Molecular FormulaC13H20N2O5
Molecular Weight284.31 g/mol
Exact Mass284.14
IUPAC Name2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate
SMILESCC(C)COC(=O)N1CCC(N2C(=O)COC2=O)CC1
InChIInChI=1S/C13H20N2O5/c1-9(2)7-19-12(17)14-5-3-10(4-6-14)15-11(16)8-20-13(15)18/h9-10H,3-8H2,1-2H3
InChIKeyHJSYYLULXADERX-UHFFFAOYSA-N
XLogP1.22
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate?
The IUPAC name of 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate (CID 67361968) is 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate.
What is the SMILES notation for 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate?
The canonical SMILES for 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate is CC(C)COC(=O)N1CCC(N2C(=O)COC2=O)CC1.
What is the InChIKey of 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate?
The InChIKey is HJSYYLULXADERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O5/c1-9(2)7-19-12(17)14-5-3-10(4-6-14)15-11(16)8-20-13(15)18/h9-10H,3-8H2,1-2H3.
What are the key properties of 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate?
2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate has a molecular weight of 284.31 g/mol, XLogP of 1.22, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl 4-(2,4-dioxo-1,3-oxazolidin-3-yl)piperidine-1-carboxylate is sourced from PubChem (CID 67361968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).