3-(methoxymethyl)pyrrolidin-2-one

C6H11NO2 — CID 10351722

IUPAC3-(methoxymethyl)pyrrolidin-2-one
SMILESCOCC1CCNC1=O
InChIInChI=1S/C6H11NO2/c1-9-4-5-2-3-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)
InChIKeyXTEMPDFELJHZGO-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.23
Rot. Bonds2

About 3-(methoxymethyl)pyrrolidin-2-one

3-(methoxymethyl)pyrrolidin-2-one (PubChem CID 10351722) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 3-(methoxymethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-(methoxymethyl)pyrrolidin-2-one
PubChem CID10351722
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name3-(methoxymethyl)pyrrolidin-2-one
SMILESCOCC1CCNC1=O
InChIInChI=1S/C6H11NO2/c1-9-4-5-2-3-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)
InChIKeyXTEMPDFELJHZGO-UHFFFAOYSA-N
XLogP-0.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethyl 2-oxopyrrolidine-3-carboxylate
CID 12699000
Methyl 2-oxopyrrolidine-3-carboxylate
CID 4738123
3-(Hydroxymethyl)pyrrolidin-2-one
CID 12698981
3-(Hydroxymethyl)-3-methylpyrrolidin-2-one
CID 84072646
2-Oxa-6-azaspiro(3.4)octan-5-one
CID 130138944
N-ethyl-3-fluorooxolane-3-carboxamide
CID 130709196
(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one
CID 175917678
5-Methoxy-3,3-dimethyl-pyrrolidin-2-one
CID 565995
3-(2,2,2-Trifluoroethoxymethyl)pyrrolidin-2-one
CID 106706808
Propan-2-yl 2-oxopyrrolidine-3-carboxylate
CID 10057961
3-(Dimethoxymethyl)pyrrolidin-2-one
CID 10080646
Methyl (R)-2-oxopyrrolidine-3-carboxylate
CID 11104704

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)pyrrolidin-2-one?
The IUPAC name of 3-(methoxymethyl)pyrrolidin-2-one (CID 10351722) is 3-(methoxymethyl)pyrrolidin-2-one.
What is the SMILES notation for 3-(methoxymethyl)pyrrolidin-2-one?
The canonical SMILES for 3-(methoxymethyl)pyrrolidin-2-one is COCC1CCNC1=O.
What is the InChIKey of 3-(methoxymethyl)pyrrolidin-2-one?
The InChIKey is XTEMPDFELJHZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-9-4-5-2-3-7-6(5)8/h5H,2-4H2,1H3,(H,7,8).
What are the key properties of 3-(methoxymethyl)pyrrolidin-2-one?
3-(methoxymethyl)pyrrolidin-2-one has a molecular weight of 129.16 g/mol, XLogP of -0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)pyrrolidin-2-one is sourced from PubChem (CID 10351722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).