4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid

C10H15NO3 — CID 70336587

IUPAC4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CNC(=O)C1C1CCCC1
InChIInChI=1S/C10H15NO3/c12-9-8(6-3-1-2-4-6)7(5-11-9)10(13)14/h6-8H,1-5H2,(H,11,12)(H,13,14)
InChIKeyKVKLSLNBKKJWIG-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.62
Rot. Bonds2

About 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid

4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid (PubChem CID 70336587) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid
PubChem CID70336587
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CNC(=O)C1C1CCCC1
InChIInChI=1S/C10H15NO3/c12-9-8(6-3-1-2-4-6)7(5-11-9)10(13)14/h6-8H,1-5H2,(H,11,12)(H,13,14)
InChIKeyKVKLSLNBKKJWIG-UHFFFAOYSA-N
XLogP0.62
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid?
The IUPAC name of 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid (CID 70336587) is 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid.
What is the SMILES notation for 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid?
The canonical SMILES for 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid is O=C(O)C1CNC(=O)C1C1CCCC1.
What is the InChIKey of 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid?
The InChIKey is KVKLSLNBKKJWIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c12-9-8(6-3-1-2-4-6)7(5-11-9)10(13)14/h6-8H,1-5H2,(H,11,12)(H,13,14).
What are the key properties of 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid?
4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid has a molecular weight of 197.23 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid is sourced from PubChem (CID 70336587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).