1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide

C7H11N3O3 — CID 3657675

IUPAC1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide
SMILESNC(=O)CN1C(=O)CCC1C(N)=O
InChIInChI=1S/C7H11N3O3/c8-5(11)3-10-4(7(9)13)1-2-6(10)12/h4H,1-3H2,(H2,8,11)(H2,9,13)
InChIKeyLBQFDLRXNAORNL-UHFFFAOYSA-N
MW185.18 g/mol
LogP-2.05
Rot. Bonds3

About 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide

1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 3657675) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID3657675
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Name1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide
SMILESNC(=O)CN1C(=O)CCC1C(N)=O
InChIInChI=1S/C7H11N3O3/c8-5(11)3-10-4(7(9)13)1-2-6(10)12/h4H,1-3H2,(H2,8,11)(H2,9,13)
InChIKeyLBQFDLRXNAORNL-UHFFFAOYSA-N
XLogP-2.05
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-2.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide (CID 3657675) is 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide is NC(=O)CN1C(=O)CCC1C(N)=O.
What is the InChIKey of 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is LBQFDLRXNAORNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c8-5(11)3-10-4(7(9)13)1-2-6(10)12/h4H,1-3H2,(H2,8,11)(H2,9,13).
What are the key properties of 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide?
1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 185.18 g/mol, XLogP of -2.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 3657675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).