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

C12H20N2O3 — CID 102870091

IUPAC1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)CN(CCO)C1CCC1
InChIInChI=1S/C12H20N2O3/c15-8-7-13(10-3-1-4-10)9-12(17)14-6-2-5-11(14)16/h10,15H,1-9H2
InChIKeyFZCQATQGLXKDCF-UHFFFAOYSA-N
MW240.30 g/mol
LogP-0.02
Rot. Bonds5

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

1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one (PubChem CID 102870091) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
PubChem CID102870091
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)CN(CCO)C1CCC1
InChIInChI=1S/C12H20N2O3/c15-8-7-13(10-3-1-4-10)9-12(17)14-6-2-5-11(14)16/h10,15H,1-9H2
InChIKeyFZCQATQGLXKDCF-UHFFFAOYSA-N
XLogP-0.02
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one (CID 102870091) is 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one is O=C1CCCN1C(=O)CN(CCO)C1CCC1.
What is the InChIKey of 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The InChIKey is FZCQATQGLXKDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c15-8-7-13(10-3-1-4-10)9-12(17)14-6-2-5-11(14)16/h10,15H,1-9H2.
What are the key properties of 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one has a molecular weight of 240.30 g/mol, XLogP of -0.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one is sourced from PubChem (CID 102870091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).