5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one

C11H19NO2 — CID 58474371

IUPAC5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one
SMILESCC(C)(C)CN1CC2CC(=O)OC2C1
InChIInChI=1S/C11H19NO2/c1-11(2,3)7-12-5-8-4-10(13)14-9(8)6-12/h8-9H,4-7H2,1-3H3
InChIKeyYYGYRVCMPUQEOF-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.28
Rot. Bonds1

About 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one

5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one (PubChem CID 58474371) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one
PubChem CID58474371
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one
SMILESCC(C)(C)CN1CC2CC(=O)OC2C1
InChIInChI=1S/C11H19NO2/c1-11(2,3)7-12-5-8-4-10(13)14-9(8)6-12/h8-9H,4-7H2,1-3H3
InChIKeyYYGYRVCMPUQEOF-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-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 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one?
The IUPAC name of 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one (CID 58474371) is 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one?
The canonical SMILES for 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one is CC(C)(C)CN1CC2CC(=O)OC2C1.
What is the InChIKey of 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one?
The InChIKey is YYGYRVCMPUQEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-11(2,3)7-12-5-8-4-10(13)14-9(8)6-12/h8-9H,4-7H2,1-3H3.
What are the key properties of 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one?
5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one has a molecular weight of 197.28 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]pyrrol-2-one is sourced from PubChem (CID 58474371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).