1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid

C11H21NO3 — CID 106979011

IUPAC1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1CCOC
InChIInChI=1S/C11H21NO3/c1-3-5-11(10(13)14)6-4-7-12(11)8-9-15-2/h3-9H2,1-2H3,(H,13,14)
InChIKeyZUTORWWIQUKVMK-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.35
Rot. Bonds6

About 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid

1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid (PubChem CID 106979011) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid
PubChem CID106979011
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1CCOC
InChIInChI=1S/C11H21NO3/c1-3-5-11(10(13)14)6-4-7-12(11)8-9-15-2/h3-9H2,1-2H3,(H,13,14)
InChIKeyZUTORWWIQUKVMK-UHFFFAOYSA-N
XLogP1.35
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethylsulfonylethyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978791
1-(2-ethylsulfanylethyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106979017
1-(2-amino-2-oxoethyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978992
2-ethyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2-carboxylic acid
CID 83070929
1-(3-methylbut-2-enyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978657
1-[3-(cyclopropylamino)-3-oxopropyl]-2-propylpyrrolidine-2-carboxylic acid
CID 106978859
1-[3-(methylcarbamoylamino)-3-oxopropyl]-2-propylpyrrolidine-2-carboxylic acid
CID 106978985
2-ethyl-1-octylpyrrolidine-2-carboxylic acid
CID 83079650
1-decyl-2-ethylpyrrolidine-2-carboxylic acid
CID 83080199
1-(2-oxo-2-pyrrolidin-1-ylethyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106979055
1-[2-(oxolan-2-yl)ethyl]-2-propylpyrrolidine-2-carboxylic acid
CID 106978881
1-(2-aminoethyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83070850

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid?
The IUPAC name of 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid (CID 106979011) is 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid is CCCC1(C(=O)O)CCCN1CCOC.
What is the InChIKey of 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid?
The InChIKey is ZUTORWWIQUKVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-3-5-11(10(13)14)6-4-7-12(11)8-9-15-2/h3-9H2,1-2H3,(H,13,14).
What are the key properties of 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid?
1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid has a molecular weight of 215.29 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-2-propylpyrrolidine-2-carboxylic acid is sourced from PubChem (CID 106979011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).