2-[(5-oxopyrrolidin-3-yl)amino]acetic acid

C6H10N2O3 — CID 54371871

IUPAC2-[(5-oxopyrrolidin-3-yl)amino]acetic acid
SMILESO=C(O)CNC1CNC(=O)C1
InChIInChI=1S/C6H10N2O3/c9-5-1-4(2-8-5)7-3-6(10)11/h4,7H,1-3H2,(H,8,9)(H,10,11)
InChIKeyUTTREVXNOTZAKF-UHFFFAOYSA-N
MW158.16 g/mol
LogP-1.45
Rot. Bonds3

About 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid

2-[(5-oxopyrrolidin-3-yl)amino]acetic acid (PubChem CID 54371871) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[(5-oxopyrrolidin-3-yl)amino]acetic acid
PubChem CID54371871
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name2-[(5-oxopyrrolidin-3-yl)amino]acetic acid
SMILESO=C(O)CNC1CNC(=O)C1
InChIInChI=1S/C6H10N2O3/c9-5-1-4(2-8-5)7-3-6(10)11/h4,7H,1-3H2,(H,8,9)(H,10,11)
InChIKeyUTTREVXNOTZAKF-UHFFFAOYSA-N
XLogP-1.45
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-1.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid?
The IUPAC name of 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid (CID 54371871) is 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid.
What is the SMILES notation for 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid?
The canonical SMILES for 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid is O=C(O)CNC1CNC(=O)C1.
What is the InChIKey of 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid?
The InChIKey is UTTREVXNOTZAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c9-5-1-4(2-8-5)7-3-6(10)11/h4,7H,1-3H2,(H,8,9)(H,10,11).
What are the key properties of 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid?
2-[(5-oxopyrrolidin-3-yl)amino]acetic acid has a molecular weight of 158.16 g/mol, XLogP of -1.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-oxopyrrolidin-3-yl)amino]acetic acid is sourced from PubChem (CID 54371871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).