3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione

C14H25N3O3 — CID 115681858

IUPAC3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione
SMILESCCN1CCOC(CNC2CC(=O)N(C(C)C)C2=O)C1
InChIInChI=1S/C14H25N3O3/c1-4-16-5-6-20-11(9-16)8-15-12-7-13(18)17(10(2)3)14(12)19/h10-12,15H,4-9H2,1-3H3
InChIKeyNMKSDGIXKCLMER-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.17
Rot. Bonds5

About 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione

3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione (PubChem CID 115681858) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione
PubChem CID115681858
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione
SMILESCCN1CCOC(CNC2CC(=O)N(C(C)C)C2=O)C1
InChIInChI=1S/C14H25N3O3/c1-4-16-5-6-20-11(9-16)8-15-12-7-13(18)17(10(2)3)14(12)19/h10-12,15H,4-9H2,1-3H3
InChIKeyNMKSDGIXKCLMER-UHFFFAOYSA-N
XLogP-0.17
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-[(4-ethylmorpholin-2-yl)methyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103931828
N-[(4-ethylmorpholin-2-yl)methyl]-1-ethylsulfonylpropan-2-amine
CID 115919948
1-propan-2-yl-3-(prop-2-ynylamino)pyrrolidine-2,5-dione
CID 43636535
3-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-1-propan-2-ylpyrrolidine-2,5-dione
CID 62990591
1-ethyl-3-(oxan-2-ylmethylamino)pyrrolidine-2,5-dione
CID 55014287
N-[(4-ethylmorpholin-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 79165540
1-[4-[(4-ethylmorpholin-2-yl)methylamino]piperidin-1-yl]ethanone
CID 115616612
3-[(4-ethylmorpholin-2-yl)methylamino]butanoic acid
CID 114399804
2-[(4-ethylmorpholin-2-yl)methyl]-1,1-dimethylhydrazine
CID 83013622
2,4-diethylmorpholine
CID 58988021
N-[(4-ethylmorpholin-2-yl)methyl]-6-methylheptan-2-amine
CID 79166729
1-cyclopropyl-N-[(4-ethylmorpholin-2-yl)methyl]propan-2-amine
CID 79166353

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione?
The IUPAC name of 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione (CID 115681858) is 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione.
What is the SMILES notation for 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione?
The canonical SMILES for 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione is CCN1CCOC(CNC2CC(=O)N(C(C)C)C2=O)C1.
What is the InChIKey of 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione?
The InChIKey is NMKSDGIXKCLMER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-4-16-5-6-20-11(9-16)8-15-12-7-13(18)17(10(2)3)14(12)19/h10-12,15H,4-9H2,1-3H3.
What are the key properties of 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione?
3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione has a molecular weight of 283.37 g/mol, XLogP of -0.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylmorpholin-2-yl)methylamino]-1-propan-2-ylpyrrolidine-2,5-dione is sourced from PubChem (CID 115681858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).