1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid

Name: 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₀H₁₆N₂O₃ — CID 10081902

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid

SMILESO=C(O)C1CCN(C(=O)C2CCCN2)C1

InChIInChI=1S/C10H16N2O3/c13-9(8-2-1-4-11-8)12-5-3-7(6-12)10(14)15/h7-8,11H,1-6H2,(H,14,15)

InChIKeyIXLHVMBLSGPVNF-UHFFFAOYSA-N

MW212.25 g/mol

LogP-0.33

Rot. Bonds2

About 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid

1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid (PubChem CID 10081902) has the molecular formula C₁₀H₁₆N₂O₃ and a molecular weight of 212.25 g/mol. Its IUPAC name is 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name	1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid
PubChem CID	10081902
Molecular Formula	C₁₀H₁₆N₂O₃
Molecular Weight	212.25 g/mol
Exact Mass	212.12
IUPAC Name	1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid
SMILES	O=C(O)C1CCN(C(=O)C2CCCN2)C1
InChI	InChI=1S/C10H16N2O3/c13-9(8-2-1-4-11-8)12-5-3-7(6-12)10(14)15/h7-8,11H,1-6H2,(H,14,15)
InChIKey	IXLHVMBLSGPVNF-UHFFFAOYSA-N
XLogP	-0.33
TPSA	69.64 Å²
H-Bond Donors	2
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	15
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	212.25
LogP ≤ 5	-0.33
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid?

The IUPAC name of 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid (CID 10081902) is 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid.

What is the SMILES notation for 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid?

The canonical SMILES for 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid is O=C(O)C1CCN(C(=O)C2CCCN2)C1.

What is the InChIKey of 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid?

The InChIKey is IXLHVMBLSGPVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-9(8-2-1-4-11-8)12-5-3-7(6-12)10(14)15/h7-8,11H,1-6H2,(H,14,15).

What are the key properties of 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid?

1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid has a molecular weight of 212.25 g/mol, XLogP of -0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(pyrrolidine-2-carbonyl)pyrrolidine-3-carboxylic acid is sourced from PubChem (CID 10081902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 10081902 — identifiers, structure, computed properties (public domain)

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