5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one

C14H22N2O3 — CID 79545472

IUPAC5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(CN2CCCCC2C2CCCC2=O)O1
InChIInChI=1S/C14H22N2O3/c17-13-6-3-4-11(13)12-5-1-2-7-16(12)9-10-8-15-14(18)19-10/h10-12H,1-9H2,(H,15,18)
InChIKeyDPQABESOGOXQJL-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.32
Rot. Bonds3

About 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one

5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one (PubChem CID 79545472) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one
PubChem CID79545472
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(CN2CCCCC2C2CCCC2=O)O1
InChIInChI=1S/C14H22N2O3/c17-13-6-3-4-11(13)12-5-1-2-7-16(12)9-10-8-15-14(18)19-10/h10-12H,1-9H2,(H,15,18)
InChIKeyDPQABESOGOXQJL-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one (CID 79545472) is 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one is O=C1NCC(CN2CCCCC2C2CCCC2=O)O1.
What is the InChIKey of 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one?
The InChIKey is DPQABESOGOXQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c17-13-6-3-4-11(13)12-5-1-2-7-16(12)9-10-8-15-14(18)19-10/h10-12H,1-9H2,(H,15,18).
What are the key properties of 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one?
5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one has a molecular weight of 266.34 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-(2-oxocyclopentyl)piperidin-1-yl]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 79545472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).