2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid

C8H11NO4 — CID 67313909

IUPAC2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid
SMILESO=C(O)N1C(=O)CC(O)C1C1CC1
InChIInChI=1S/C8H11NO4/c10-5-3-6(11)9(8(12)13)7(5)4-1-2-4/h4-5,7,10H,1-3H2,(H,12,13)
InChIKeyQDWWDMNWILFVSH-UHFFFAOYSA-N
MW185.18 g/mol
LogP0.04
Rot. Bonds1

About 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid

2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid (PubChem CID 67313909) has the molecular formula C8H11NO4 and a molecular weight of 185.18 g/mol. Its IUPAC name is 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid.

Molecular Properties

Compound Name2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid
PubChem CID67313909
Molecular FormulaC8H11NO4
Molecular Weight185.18 g/mol
Exact Mass185.07
IUPAC Name2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid
SMILESO=C(O)N1C(=O)CC(O)C1C1CC1
InChIInChI=1S/C8H11NO4/c10-5-3-6(11)9(8(12)13)7(5)4-1-2-4/h4-5,7,10H,1-3H2,(H,12,13)
InChIKeyQDWWDMNWILFVSH-UHFFFAOYSA-N
XLogP0.04
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid?
The IUPAC name of 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid (CID 67313909) is 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid.
What is the SMILES notation for 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid?
The canonical SMILES for 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid is O=C(O)N1C(=O)CC(O)C1C1CC1.
What is the InChIKey of 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid?
The InChIKey is QDWWDMNWILFVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO4/c10-5-3-6(11)9(8(12)13)7(5)4-1-2-4/h4-5,7,10H,1-3H2,(H,12,13).
What are the key properties of 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid?
2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid has a molecular weight of 185.18 g/mol, XLogP of 0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-hydroxy-5-oxopyrrolidine-1-carboxylic acid is sourced from PubChem (CID 67313909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).