3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide

C7H12N2O3 — CID 3052160

IUPAC3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
SMILESNC(=O)CCN1CC(O)CC1=O
InChIInChI=1S/C7H12N2O3/c8-6(11)1-2-9-4-5(10)3-7(9)12/h5,10H,1-4H2,(H2,8,11)
InChIKeyURSOMCJSYBJWSF-UHFFFAOYSA-N
MW172.18 g/mol
LogP-1.54
Rot. Bonds3

About 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide

3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide (PubChem CID 3052160) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
PubChem CID3052160
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
SMILESNC(=O)CCN1CC(O)CC1=O
InChIInChI=1S/C7H12N2O3/c8-6(11)1-2-9-4-5(10)3-7(9)12/h5,10H,1-4H2,(H2,8,11)
InChIKeyURSOMCJSYBJWSF-UHFFFAOYSA-N
XLogP-1.54
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-1.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide?
The IUPAC name of 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide (CID 3052160) is 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide?
The canonical SMILES for 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide is NC(=O)CCN1CC(O)CC1=O.
What is the InChIKey of 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide?
The InChIKey is URSOMCJSYBJWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c8-6(11)1-2-9-4-5(10)3-7(9)12/h5,10H,1-4H2,(H2,8,11).
What are the key properties of 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide?
3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide has a molecular weight of 172.18 g/mol, XLogP of -1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 3052160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).