5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one

C12H20N2O3 — CID 3429043

IUPAC5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1C(=O)CCC1C(=O)N1CCOCC1
InChIInChI=1S/C12H20N2O3/c1-9(2)14-10(3-4-11(14)15)12(16)13-5-7-17-8-6-13/h9-10H,3-8H2,1-2H3
InChIKeyVSRQJVFPXJCRFZ-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.24
Rot. Bonds2

About 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one

5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one (PubChem CID 3429043) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one.

Molecular Properties

Compound Name5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one
PubChem CID3429043
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1C(=O)CCC1C(=O)N1CCOCC1
InChIInChI=1S/C12H20N2O3/c1-9(2)14-10(3-4-11(14)15)12(16)13-5-7-17-8-6-13/h9-10H,3-8H2,1-2H3
InChIKeyVSRQJVFPXJCRFZ-UHFFFAOYSA-N
XLogP0.24
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Morpholine, 4-((2-oxo-1-pyrrolidinyl)acetyl)-
CID 746914
Ethyl 4-(1-isopropyl-5-oxoprolyl)piperazine-1-carboxylate
CID 3240412
1-Ethyl-3-morpholinopyrrolidine-2,5-dione
CID 2942382
1-cyclohexyl-N-(2-morpholin-4-ylethyl)-5-oxoprolinamide
CID 3237581
1-Morpholin-4-yl-4-[(S)-2-(pyrrolidine-1-carbonyl)-pyrrolidin-1-yl]-butane-1,4-dione
CID 11348314
2-[4-(2-Ethoxyethyl)-3-ethylpiperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53596202
2-[4-(2-Ethoxyethyl)-3-methylpiperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53610261
2-[3-Ethyl-4-(2-methoxyethyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53610274
1-(1-Morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-2,5-dione
CID 73357924
1-(1-Morpholin-4-yl-1-oxobutan-2-yl)pyrrolidine-2,5-dione
CID 122178891
1-Butyl-3-morpholin-4-ylpyrrolidine-2,5-dione
CID 2948350
1-Isopropyl-3-(4-morpholinyl)-2,5-pyrrolidinedione
CID 2992675

Frequently Asked Questions

What is the IUPAC name of 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one?
The IUPAC name of 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one (CID 3429043) is 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one.
What is the SMILES notation for 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one?
The canonical SMILES for 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one is CC(C)N1C(=O)CCC1C(=O)N1CCOCC1.
What is the InChIKey of 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one?
The InChIKey is VSRQJVFPXJCRFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-9(2)14-10(3-4-11(14)15)12(16)13-5-7-17-8-6-13/h9-10H,3-8H2,1-2H3.
What are the key properties of 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one?
5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one has a molecular weight of 240.30 g/mol, XLogP of 0.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholine-4-carbonyl)-1-propan-2-ylpyrrolidin-2-one is sourced from PubChem (CID 3429043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).