1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid

C14H24N2O4 — CID 63152373

IUPAC1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid
SMILESCCCC1(C(=O)O)CCN(CC(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O4/c1-2-3-14(13(18)19)4-5-15(11-14)10-12(17)16-6-8-20-9-7-16/h2-11H2,1H3,(H,18,19)
InChIKeyWJYJKVAYLZEVEP-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.42
Rot. Bonds5

About 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid

1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid (PubChem CID 63152373) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid
PubChem CID63152373
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid
SMILESCCCC1(C(=O)O)CCN(CC(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O4/c1-2-3-14(13(18)19)4-5-15(11-14)10-12(17)16-6-8-20-9-7-16/h2-11H2,1H3,(H,18,19)
InChIKeyWJYJKVAYLZEVEP-UHFFFAOYSA-N
XLogP0.42
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid?
The IUPAC name of 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid (CID 63152373) is 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid.
What is the SMILES notation for 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid?
The canonical SMILES for 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid is CCCC1(C(=O)O)CCN(CC(=O)N2CCOCC2)C1.
What is the InChIKey of 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid?
The InChIKey is WJYJKVAYLZEVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-2-3-14(13(18)19)4-5-15(11-14)10-12(17)16-6-8-20-9-7-16/h2-11H2,1H3,(H,18,19).
What are the key properties of 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid?
1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 0.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-yl-2-oxoethyl)-3-propylpyrrolidine-3-carboxylic acid is sourced from PubChem (CID 63152373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).