1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid

C15H25NO3 — CID 83075961

IUPAC1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid
SMILESCCC1(C(=O)O)CCCN1C(=O)CCC1CCCC1
InChIInChI=1S/C15H25NO3/c1-2-15(14(18)19)10-5-11-16(15)13(17)9-8-12-6-3-4-7-12/h12H,2-11H2,1H3,(H,18,19)
InChIKeyDWXKPKKJPKYMPG-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.81
Rot. Bonds5

About 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid

1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid (PubChem CID 83075961) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid
PubChem CID83075961
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid
SMILESCCC1(C(=O)O)CCCN1C(=O)CCC1CCCC1
InChIInChI=1S/C15H25NO3/c1-2-15(14(18)19)10-5-11-16(15)13(17)9-8-12-6-3-4-7-12/h12H,2-11H2,1H3,(H,18,19)
InChIKeyDWXKPKKJPKYMPG-UHFFFAOYSA-N
XLogP2.81
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-aminopropanoyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83071327
1-(2-cyclohexylethylcarbamoyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83063989
2-ethyl-1-[2-(thian-4-yl)acetyl]pyrrolidine-2-carboxylic acid
CID 83145192
1-(2-aminoacetyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83070500
(2R)-2-ethylpyrrolidine-1,2-dicarboxylic acid
CID 91369752
2-ethyl-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]pyrrolidine-2-carboxylic acid
CID 112602393
1-(5-amino-4-methylpentanoyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83071106
2-ethyl-1-(3-phenylpropanoyl)pyrrolidine-2-carboxylic acid
CID 83076112
2-ethyl-1-[2-(ethylamino)acetyl]pyrrolidine-2-carboxylic acid
CID 83070348
1-(1-aminocyclopropanecarbonyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83070879
1-[(2S)-2-amino-3-cyclopropylpropanoyl]-2-ethylpyrrolidine-2-carboxylic acid
CID 112735416
2-ethyl-1-(4-methylcyclohexanecarbonyl)pyrrolidine-2-carboxylic acid
CID 83075872

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid?
The IUPAC name of 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid (CID 83075961) is 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid is CCC1(C(=O)O)CCCN1C(=O)CCC1CCCC1.
What is the InChIKey of 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid?
The InChIKey is DWXKPKKJPKYMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-2-15(14(18)19)10-5-11-16(15)13(17)9-8-12-6-3-4-7-12/h12H,2-11H2,1H3,(H,18,19).
What are the key properties of 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid?
1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid has a molecular weight of 267.37 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentylpropanoyl)-2-ethylpyrrolidine-2-carboxylic acid is sourced from PubChem (CID 83075961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).