1-[2-(diethylamino)acetyl]pyrrolidin-2-one

C10H18N2O2 — CID 746985

IUPAC1-[2-(diethylamino)acetyl]pyrrolidin-2-one
SMILESCCN(CC)CC(=O)N1CCCC1=O
InChIInChI=1S/C10H18N2O2/c1-3-11(4-2)8-10(14)12-7-5-6-9(12)13/h3-8H2,1-2H3
InChIKeyCZAPYALYGFSGGY-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.48
Rot. Bonds4

About 1-[2-(diethylamino)acetyl]pyrrolidin-2-one

1-[2-(diethylamino)acetyl]pyrrolidin-2-one (PubChem CID 746985) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-[2-(diethylamino)acetyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-(diethylamino)acetyl]pyrrolidin-2-one
PubChem CID746985
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-[2-(diethylamino)acetyl]pyrrolidin-2-one
SMILESCCN(CC)CC(=O)N1CCCC1=O
InChIInChI=1S/C10H18N2O2/c1-3-11(4-2)8-10(14)12-7-5-6-9(12)13/h3-8H2,1-2H3
InChIKeyCZAPYALYGFSGGY-UHFFFAOYSA-N
XLogP0.48
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(diethylamino)acetyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-(diethylamino)acetyl]pyrrolidin-2-one (CID 746985) is 1-[2-(diethylamino)acetyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-(diethylamino)acetyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-(diethylamino)acetyl]pyrrolidin-2-one is CCN(CC)CC(=O)N1CCCC1=O.
What is the InChIKey of 1-[2-(diethylamino)acetyl]pyrrolidin-2-one?
The InChIKey is CZAPYALYGFSGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-3-11(4-2)8-10(14)12-7-5-6-9(12)13/h3-8H2,1-2H3.
What are the key properties of 1-[2-(diethylamino)acetyl]pyrrolidin-2-one?
1-[2-(diethylamino)acetyl]pyrrolidin-2-one has a molecular weight of 198.27 g/mol, XLogP of 0.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(diethylamino)acetyl]pyrrolidin-2-one is sourced from PubChem (CID 746985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).