3-[(2-ethylcyclopentyl)amino]oxolan-2-one

C11H19NO2 — CID 126987001

IUPAC3-[(2-ethylcyclopentyl)amino]oxolan-2-one
SMILESCCC1CCCC1NC1CCOC1=O
InChIInChI=1S/C11H19NO2/c1-2-8-4-3-5-9(8)12-10-6-7-14-11(10)13/h8-10,12H,2-7H2,1H3
InChIKeyXPDJYULAQAKFOK-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds3

About 3-[(2-ethylcyclopentyl)amino]oxolan-2-one

3-[(2-ethylcyclopentyl)amino]oxolan-2-one (PubChem CID 126987001) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-[(2-ethylcyclopentyl)amino]oxolan-2-one.

Molecular Properties

Compound Name3-[(2-ethylcyclopentyl)amino]oxolan-2-one
PubChem CID126987001
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3-[(2-ethylcyclopentyl)amino]oxolan-2-one
SMILESCCC1CCCC1NC1CCOC1=O
InChIInChI=1S/C11H19NO2/c1-2-8-4-3-5-9(8)12-10-6-7-14-11(10)13/h8-10,12H,2-7H2,1H3
InChIKeyXPDJYULAQAKFOK-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethylcyclopentyl)amino]oxolan-2-one?
The IUPAC name of 3-[(2-ethylcyclopentyl)amino]oxolan-2-one (CID 126987001) is 3-[(2-ethylcyclopentyl)amino]oxolan-2-one.
What is the SMILES notation for 3-[(2-ethylcyclopentyl)amino]oxolan-2-one?
The canonical SMILES for 3-[(2-ethylcyclopentyl)amino]oxolan-2-one is CCC1CCCC1NC1CCOC1=O.
What is the InChIKey of 3-[(2-ethylcyclopentyl)amino]oxolan-2-one?
The InChIKey is XPDJYULAQAKFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-2-8-4-3-5-9(8)12-10-6-7-14-11(10)13/h8-10,12H,2-7H2,1H3.
What are the key properties of 3-[(2-ethylcyclopentyl)amino]oxolan-2-one?
3-[(2-ethylcyclopentyl)amino]oxolan-2-one has a molecular weight of 197.28 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethylcyclopentyl)amino]oxolan-2-one is sourced from PubChem (CID 126987001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).