1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione

C10H14N2O3 — CID 66196689

IUPAC1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione
SMILESCCOC1CC(N)C1N1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O3/c1-2-15-7-5-6(11)10(7)12-8(13)3-4-9(12)14/h3-4,6-7,10H,2,5,11H2,1H3
InChIKeyQOGZQVMGLCLZIJ-UHFFFAOYSA-N
MW210.23 g/mol
LogP-0.58
Rot. Bonds3

About 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione

1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione (PubChem CID 66196689) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione
PubChem CID66196689
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione
SMILESCCOC1CC(N)C1N1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O3/c1-2-15-7-5-6(11)10(7)12-8(13)3-4-9(12)14/h3-4,6-7,10H,2,5,11H2,1H3
InChIKeyQOGZQVMGLCLZIJ-UHFFFAOYSA-N
XLogP-0.58
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione 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-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione?
The IUPAC name of 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione (CID 66196689) is 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione is CCOC1CC(N)C1N1C(=O)C=CC1=O.
What is the InChIKey of 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione?
The InChIKey is QOGZQVMGLCLZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-2-15-7-5-6(11)10(7)12-8(13)3-4-9(12)14/h3-4,6-7,10H,2,5,11H2,1H3.
What are the key properties of 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione?
1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione has a molecular weight of 210.23 g/mol, XLogP of -0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-4-ethoxycyclobutyl)pyrrole-2,5-dione is sourced from PubChem (CID 66196689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).