2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid

C15H22N2O4 — CID 129365611

IUPAC2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid
SMILESO=C(O)CN(C(=O)[C@H]1CC(=O)N(C2CCCC2)C1)C1CC1
InChIInChI=1S/C15H22N2O4/c18-13-7-10(8-16(13)11-3-1-2-4-11)15(21)17(9-14(19)20)12-5-6-12/h10-12H,1-9H2,(H,19,20)/t10-/m0/s1
InChIKeyULXUWXSBBCSNIY-JTQLQIEISA-N
MW294.35 g/mol
LogP0.85
Rot. Bonds5

About 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid

2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid (PubChem CID 129365611) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid.

Molecular Properties

Compound Name2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid
PubChem CID129365611
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid
SMILESO=C(O)CN(C(=O)[C@H]1CC(=O)N(C2CCCC2)C1)C1CC1
InChIInChI=1S/C15H22N2O4/c18-13-7-10(8-16(13)11-3-1-2-4-11)15(21)17(9-14(19)20)12-5-6-12/h10-12H,1-9H2,(H,19,20)/t10-/m0/s1
InChIKeyULXUWXSBBCSNIY-JTQLQIEISA-N
XLogP0.85
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic 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 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid?
The IUPAC name of 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid (CID 129365611) is 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid.
What is the SMILES notation for 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid?
The canonical SMILES for 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid is O=C(O)CN(C(=O)[C@H]1CC(=O)N(C2CCCC2)C1)C1CC1.
What is the InChIKey of 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid?
The InChIKey is ULXUWXSBBCSNIY-JTQLQIEISA-N. The full InChI is InChI=1S/C15H22N2O4/c18-13-7-10(8-16(13)11-3-1-2-4-11)15(21)17(9-14(19)20)12-5-6-12/h10-12H,1-9H2,(H,19,20)/t10-/m0/s1.
What are the key properties of 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid?
2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid has a molecular weight of 294.35 g/mol, XLogP of 0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]-cyclopropylamino]acetic acid is sourced from PubChem (CID 129365611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).