1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid

C13H23NO2 — CID 106978679

IUPAC1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1C1CCCC1
InChIInChI=1S/C13H23NO2/c1-2-8-13(12(15)16)9-5-10-14(13)11-6-3-4-7-11/h11H,2-10H2,1H3,(H,15,16)
InChIKeyZOUMAYIWNSUHDU-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.65
Rot. Bonds4

About 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid

1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid (PubChem CID 106978679) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid
PubChem CID106978679
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1C1CCCC1
InChIInChI=1S/C13H23NO2/c1-2-8-13(12(15)16)9-5-10-14(13)11-6-3-4-7-11/h11H,2-10H2,1H3,(H,15,16)
InChIKeyZOUMAYIWNSUHDU-UHFFFAOYSA-N
XLogP2.65
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-(4-ethylcycloheptyl)pyrrolidine-2-carboxylic acid
CID 83080208
2-ethyl-1-(oxepan-4-yl)pyrrolidine-2-carboxylic acid
CID 83080819
1-(cyclohexylcarbamoyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977361
1-(2,2-difluoroacetyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977115
1-(1-cyanoethyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978796
1-(piperidine-2-carbonyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106975985
2-ethyl-1-(3-methylsulfonylcyclohexyl)pyrrolidine-2-carboxylic acid
CID 83080272
1-(2-ethylpiperidine-1-carbonyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978208
1-(2-aminocycloheptanecarbonyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106976030
1-(1-amino-1-oxopropan-2-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106978795
1-(2-piperidin-3-ylacetyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106976153
2-propylpiperidine-1,2-dicarboxylic acid
CID 90772513

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid?
The IUPAC name of 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid (CID 106978679) is 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid is CCCC1(C(=O)O)CCCN1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid?
The InChIKey is ZOUMAYIWNSUHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-2-8-13(12(15)16)9-5-10-14(13)11-6-3-4-7-11/h11H,2-10H2,1H3,(H,15,16).
What are the key properties of 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid?
1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid has a molecular weight of 225.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-propylpyrrolidine-2-carboxylic acid is sourced from PubChem (CID 106978679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).