ethane;5-methoxypyrrolidin-2-one

C7H15NO2 — CID 145305312

IUPACethane;5-methoxypyrrolidin-2-one
SMILESCC.COC1CCC(=O)N1
InChIInChI=1S/C5H9NO2.C2H6/c1-8-5-3-2-4(7)6-5;1-2/h5H,2-3H2,1H3,(H,6,7);1-2H3
InChIKeyQSFCKYPULZYSRC-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.90
Rot. Bonds1

About ethane;5-methoxypyrrolidin-2-one

ethane;5-methoxypyrrolidin-2-one (PubChem CID 145305312) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is ethane;5-methoxypyrrolidin-2-one.

Molecular Properties

Compound Nameethane;5-methoxypyrrolidin-2-one
PubChem CID145305312
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Nameethane;5-methoxypyrrolidin-2-one
SMILESCC.COC1CCC(=O)N1
InChIInChI=1S/C5H9NO2.C2H6/c1-8-5-3-2-4(7)6-5;1-2/h5H,2-3H2,1H3,(H,6,7);1-2H3
InChIKeyQSFCKYPULZYSRC-UHFFFAOYSA-N
XLogP0.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;5-methoxypyrrolidin-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 ethane;5-methoxypyrrolidin-2-one?
The IUPAC name of ethane;5-methoxypyrrolidin-2-one (CID 145305312) is ethane;5-methoxypyrrolidin-2-one.
What is the SMILES notation for ethane;5-methoxypyrrolidin-2-one?
The canonical SMILES for ethane;5-methoxypyrrolidin-2-one is CC.COC1CCC(=O)N1.
What is the InChIKey of ethane;5-methoxypyrrolidin-2-one?
The InChIKey is QSFCKYPULZYSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.C2H6/c1-8-5-3-2-4(7)6-5;1-2/h5H,2-3H2,1H3,(H,6,7);1-2H3.
What are the key properties of ethane;5-methoxypyrrolidin-2-one?
ethane;5-methoxypyrrolidin-2-one has a molecular weight of 145.20 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxypyrrolidin-2-one is sourced from PubChem (CID 145305312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).