4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one

C8H15NO2 — CID 45090961

IUPAC4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one
SMILESCC(C)(C)OC1CNC(=O)C1
InChIInChI=1S/C8H15NO2/c1-8(2,3)11-6-4-7(10)9-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyVMJJDPQSCOVAIM-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.69
Rot. Bonds1

About 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one

4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one (PubChem CID 45090961) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one
PubChem CID45090961
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one
SMILESCC(C)(C)OC1CNC(=O)C1
InChIInChI=1S/C8H15NO2/c1-8(2,3)11-6-4-7(10)9-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyVMJJDPQSCOVAIM-UHFFFAOYSA-N
XLogP0.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[(2-methylpropan-2-yl)oxy]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

Related Compounds

CID 12365590
CID 12365590
CID 22627013
CID 22627013
CID 126551320
CID 126551320
CID 22926297
CID 22926297
CID 134850659
CID 134850659
CID 130694673
CID 130694673
CID 10441804
CID 10441804
CID 10888164
CID 10888164
CID 18442687
CID 18442687
CID 23037464
CID 23037464
CID 57229408
CID 57229408
CID 58333487
CID 58333487

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one?
The IUPAC name of 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one (CID 45090961) is 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one.
What is the SMILES notation for 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one?
The canonical SMILES for 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one is CC(C)(C)OC1CNC(=O)C1.
What is the InChIKey of 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one?
The InChIKey is VMJJDPQSCOVAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-8(2,3)11-6-4-7(10)9-5-6/h6H,4-5H2,1-3H3,(H,9,10).
What are the key properties of 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one?
4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one has a molecular weight of 157.21 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpropan-2-yl)oxy]pyrrolidin-2-one is sourced from PubChem (CID 45090961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).