5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one

C11H20N2O2 — CID 107529690

IUPAC5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one
SMILESCC1(CNCC2CCC(=O)N2)CCCO1
InChIInChI=1S/C11H20N2O2/c1-11(5-2-6-15-11)8-12-7-9-3-4-10(14)13-9/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyZGFOFCLIHJOICR-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.42
Rot. Bonds4

About 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one

5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one (PubChem CID 107529690) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one
PubChem CID107529690
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one
SMILESCC1(CNCC2CCC(=O)N2)CCCO1
InChIInChI=1S/C11H20N2O2/c1-11(5-2-6-15-11)8-12-7-9-3-4-10(14)13-9/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyZGFOFCLIHJOICR-UHFFFAOYSA-N
XLogP0.42
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one?
The IUPAC name of 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one (CID 107529690) is 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one?
The canonical SMILES for 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one is CC1(CNCC2CCC(=O)N2)CCCO1.
What is the InChIKey of 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one?
The InChIKey is ZGFOFCLIHJOICR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-11(5-2-6-15-11)8-12-7-9-3-4-10(14)13-9/h9,12H,2-8H2,1H3,(H,13,14).
What are the key properties of 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one?
5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one has a molecular weight of 212.29 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one is sourced from PubChem (CID 107529690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).