3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one

C11H20N2O2 — CID 82728265

IUPAC3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one
SMILESCCNC1CCN(C2CCOC2C)C1=O
InChIInChI=1S/C11H20N2O2/c1-3-12-9-4-6-13(11(9)14)10-5-7-15-8(10)2/h8-10,12H,3-7H2,1-2H3
InChIKeyBVDRBRUONQVXJP-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.37
Rot. Bonds3

About 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one

3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one (PubChem CID 82728265) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one
PubChem CID82728265
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one
SMILESCCNC1CCN(C2CCOC2C)C1=O
InChIInChI=1S/C11H20N2O2/c1-3-12-9-4-6-13(11(9)14)10-5-7-15-8(10)2/h8-10,12H,3-7H2,1-2H3
InChIKeyBVDRBRUONQVXJP-UHFFFAOYSA-N
XLogP0.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one?
The IUPAC name of 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one (CID 82728265) is 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one.
What is the SMILES notation for 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one?
The canonical SMILES for 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one is CCNC1CCN(C2CCOC2C)C1=O.
What is the InChIKey of 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one?
The InChIKey is BVDRBRUONQVXJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-12-9-4-6-13(11(9)14)10-5-7-15-8(10)2/h8-10,12H,3-7H2,1-2H3.
What are the key properties of 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one?
3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one has a molecular weight of 212.29 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one is sourced from PubChem (CID 82728265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).