5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one

C10H17NO2 — CID 82837252

IUPAC5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one
SMILESCCC1NC(=O)CC1C1CCCO1
InChIInChI=1S/C10H17NO2/c1-2-8-7(6-10(12)11-8)9-4-3-5-13-9/h7-9H,2-6H2,1H3,(H,11,12)
InChIKeyIFCWTLBEGOTVTL-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.08
Rot. Bonds2

About 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one

5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one (PubChem CID 82837252) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one
PubChem CID82837252
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one
SMILESCCC1NC(=O)CC1C1CCCO1
InChIInChI=1S/C10H17NO2/c1-2-8-7(6-10(12)11-8)9-4-3-5-13-9/h7-9H,2-6H2,1H3,(H,11,12)
InChIKeyIFCWTLBEGOTVTL-UHFFFAOYSA-N
XLogP1.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one?
The IUPAC name of 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one (CID 82837252) is 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one?
The canonical SMILES for 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one is CCC1NC(=O)CC1C1CCCO1.
What is the InChIKey of 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one?
The InChIKey is IFCWTLBEGOTVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-2-8-7(6-10(12)11-8)9-4-3-5-13-9/h7-9H,2-6H2,1H3,(H,11,12).
What are the key properties of 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one?
5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one has a molecular weight of 183.25 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(oxolan-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 82837252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).