(2R)-2-formylpyrrolidine-1-carboxylic acid

C6H9NO3 — CID 18644465

IUPAC(2R)-2-formylpyrrolidine-1-carboxylic acid
SMILESO=C[C@H]1CCCN1C(=O)O
InChIInChI=1S/C6H9NO3/c8-4-5-2-1-3-7(5)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m1/s1
InChIKeyFTVFUMMKOGYFCJ-RXMQYKEDSA-N
MW143.14 g/mol
LogP0.33
Rot. Bonds1

About (2R)-2-formylpyrrolidine-1-carboxylic acid

(2R)-2-formylpyrrolidine-1-carboxylic acid (PubChem CID 18644465) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is (2R)-2-formylpyrrolidine-1-carboxylic acid.

Molecular Properties

Compound Name(2R)-2-formylpyrrolidine-1-carboxylic acid
PubChem CID18644465
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name(2R)-2-formylpyrrolidine-1-carboxylic acid
SMILESO=C[C@H]1CCCN1C(=O)O
InChIInChI=1S/C6H9NO3/c8-4-5-2-1-3-7(5)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m1/s1
InChIKeyFTVFUMMKOGYFCJ-RXMQYKEDSA-N
XLogP0.33
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze (2R)-2-formylpyrrolidine-1-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

Frequently Asked Questions

What is the IUPAC name of (2R)-2-formylpyrrolidine-1-carboxylic acid?
The IUPAC name of (2R)-2-formylpyrrolidine-1-carboxylic acid (CID 18644465) is (2R)-2-formylpyrrolidine-1-carboxylic acid.
What is the SMILES notation for (2R)-2-formylpyrrolidine-1-carboxylic acid?
The canonical SMILES for (2R)-2-formylpyrrolidine-1-carboxylic acid is O=C[C@H]1CCCN1C(=O)O.
What is the InChIKey of (2R)-2-formylpyrrolidine-1-carboxylic acid?
The InChIKey is FTVFUMMKOGYFCJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H9NO3/c8-4-5-2-1-3-7(5)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m1/s1.
What are the key properties of (2R)-2-formylpyrrolidine-1-carboxylic acid?
(2R)-2-formylpyrrolidine-1-carboxylic acid has a molecular weight of 143.14 g/mol, XLogP of 0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-formylpyrrolidine-1-carboxylic acid is sourced from PubChem (CID 18644465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).