5-[2-(dimethylamino)ethyl]pyrrolidin-2-one

C8H16N2O — CID 13306711

IUPAC5-[2-(dimethylamino)ethyl]pyrrolidin-2-one
SMILESCN(C)CCC1CCC(=O)N1
InChIInChI=1S/C8H16N2O/c1-10(2)6-5-7-3-4-8(11)9-7/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyKHLJWFTVWAGAPN-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.22
Rot. Bonds3

About 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one

5-[2-(dimethylamino)ethyl]pyrrolidin-2-one (PubChem CID 13306711) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[2-(dimethylamino)ethyl]pyrrolidin-2-one
PubChem CID13306711
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name5-[2-(dimethylamino)ethyl]pyrrolidin-2-one
SMILESCN(C)CCC1CCC(=O)N1
InChIInChI=1S/C8H16N2O/c1-10(2)6-5-7-3-4-8(11)9-7/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyKHLJWFTVWAGAPN-UHFFFAOYSA-N
XLogP0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one?
The IUPAC name of 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one (CID 13306711) is 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one?
The canonical SMILES for 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one is CN(C)CCC1CCC(=O)N1.
What is the InChIKey of 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one?
The InChIKey is KHLJWFTVWAGAPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-10(2)6-5-7-3-4-8(11)9-7/h7H,3-6H2,1-2H3,(H,9,11).
What are the key properties of 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one?
5-[2-(dimethylamino)ethyl]pyrrolidin-2-one has a molecular weight of 156.23 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(dimethylamino)ethyl]pyrrolidin-2-one is sourced from PubChem (CID 13306711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).