1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one

C11H20N2O3 — CID 60691855

IUPAC1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one
SMILESCC(C)N(CCO)CC(=O)N1CCCC1=O
InChIInChI=1S/C11H20N2O3/c1-9(2)12(6-7-14)8-11(16)13-5-3-4-10(13)15/h9,14H,3-8H2,1-2H3
InChIKeyISCBFLGSSIDYMA-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.16
Rot. Bonds5

About 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one

1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one (PubChem CID 60691855) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one
PubChem CID60691855
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one
SMILESCC(C)N(CCO)CC(=O)N1CCCC1=O
InChIInChI=1S/C11H20N2O3/c1-9(2)12(6-7-14)8-11(16)13-5-3-4-10(13)15/h9,14H,3-8H2,1-2H3
InChIKeyISCBFLGSSIDYMA-UHFFFAOYSA-N
XLogP-0.16
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one (CID 60691855) is 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one is CC(C)N(CCO)CC(=O)N1CCCC1=O.
What is the InChIKey of 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one?
The InChIKey is ISCBFLGSSIDYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-9(2)12(6-7-14)8-11(16)13-5-3-4-10(13)15/h9,14H,3-8H2,1-2H3.
What are the key properties of 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one?
1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one has a molecular weight of 228.29 g/mol, XLogP of -0.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]pyrrolidin-2-one is sourced from PubChem (CID 60691855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).