2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide

C11H21N3O2 — CID 63171230

IUPAC2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide
SMILESCC(C(N)=O)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C11H21N3O2/c1-9(11(12)15)14-3-2-10(8-14)13-4-6-16-7-5-13/h9-10H,2-8H2,1H3,(H2,12,15)
InChIKeyMDIRLVDUOSJJLK-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.73
Rot. Bonds3

About 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide

2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide (PubChem CID 63171230) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide
PubChem CID63171230
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide
SMILESCC(C(N)=O)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C11H21N3O2/c1-9(11(12)15)14-3-2-10(8-14)13-4-6-16-7-5-13/h9-10H,2-8H2,1H3,(H2,12,15)
InChIKeyMDIRLVDUOSJJLK-UHFFFAOYSA-N
XLogP-0.73
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide?
The IUPAC name of 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide (CID 63171230) is 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide.
What is the SMILES notation for 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide?
The canonical SMILES for 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide is CC(C(N)=O)N1CCC(N2CCOCC2)C1.
What is the InChIKey of 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide?
The InChIKey is MDIRLVDUOSJJLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-9(11(12)15)14-3-2-10(8-14)13-4-6-16-7-5-13/h9-10H,2-8H2,1H3,(H2,12,15).
What are the key properties of 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide?
2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide has a molecular weight of 227.31 g/mol, XLogP of -0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-morpholin-4-ylpyrrolidin-1-yl)propanamide is sourced from PubChem (CID 63171230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).