1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one

C12H22N2O2 — CID 10704448

IUPAC1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one
SMILESCC(CN1CCOCC1)CN1CCCC1=O
InChIInChI=1S/C12H22N2O2/c1-11(9-13-5-7-16-8-6-13)10-14-4-2-3-12(14)15/h11H,2-10H2,1H3
InChIKeyAMELVSUHWYGMDY-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.58
Rot. Bonds4

About 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one

1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one (PubChem CID 10704448) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one
PubChem CID10704448
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one
SMILESCC(CN1CCOCC1)CN1CCCC1=O
InChIInChI=1S/C12H22N2O2/c1-11(9-13-5-7-16-8-6-13)10-14-4-2-3-12(14)15/h11H,2-10H2,1H3
InChIKeyAMELVSUHWYGMDY-UHFFFAOYSA-N
XLogP0.58
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Morpholine, 4-((2-oxo-1-pyrrolidinyl)acetyl)-
CID 746914
Ammonium, (2-(2-(2-oxo-1-pyrrolidinyl)ethoxy)ethyl)trimethyl-, iodide
CID 20000
1-[3-(2-Morpholin-4-yl-2-oxoethyl)pyrrolidin-1-yl]propan-1-one
CID 110196134
3-Methyl-1-(morpholin-4-ylmethyl)pyrrolidine-2,5-dione
CID 137646623
rac-4-[(3R,4R)-4-methylpyrrolidine-3-carbonyl]morpholine hydrochloride
CID 119031893
4-(Morpholinomethyl)pyrrolidin-2-one
CID 91623583
3-[4-(Cyclopropylcarbonyl)piperazino]-1-(2-methoxyethyl)-2-pyrrolidinone
CID 91925716
(S)-1-methyl-3-morpholino-2-pyrrolidinone
CID 100664669
3-Methyl-1-morpholin-4-ylbutan-1-one
CID 4557865
4-(2-Methylbutanoyl)morpholine
CID 4631080
1-[2-[4-(2-Methoxyethyl)piperazin-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 1822554
1-[2-[4-(2-Ethoxyethyl)piperazin-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 1822705

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one (CID 10704448) is 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one is CC(CN1CCOCC1)CN1CCCC1=O.
What is the InChIKey of 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one?
The InChIKey is AMELVSUHWYGMDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-11(9-13-5-7-16-8-6-13)10-14-4-2-3-12(14)15/h11H,2-10H2,1H3.
What are the key properties of 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one?
1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one has a molecular weight of 226.32 g/mol, XLogP of 0.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one is sourced from PubChem (CID 10704448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).