3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide

C7H10N2O3 — CID 123824059

IUPAC3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide
SMILESNC(=O)CCN1C(=O)C=CC1O
InChIInChI=1S/C7H10N2O3/c8-5(10)3-4-9-6(11)1-2-7(9)12/h1-2,6,11H,3-4H2,(H2,8,10)
InChIKeyLBYNFDYZOCNDQL-UHFFFAOYSA-N
MW170.17 g/mol
LogP-1.42
Rot. Bonds3

About 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide

3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide (PubChem CID 123824059) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide.

Molecular Properties

Compound Name3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide
PubChem CID123824059
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC Name3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide
SMILESNC(=O)CCN1C(=O)C=CC1O
InChIInChI=1S/C7H10N2O3/c8-5(10)3-4-9-6(11)1-2-7(9)12/h1-2,6,11H,3-4H2,(H2,8,10)
InChIKeyLBYNFDYZOCNDQL-UHFFFAOYSA-N
XLogP-1.42
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-1.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide?
The IUPAC name of 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide (CID 123824059) is 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide.
What is the SMILES notation for 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide?
The canonical SMILES for 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide is NC(=O)CCN1C(=O)C=CC1O.
What is the InChIKey of 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide?
The InChIKey is LBYNFDYZOCNDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c8-5(10)3-4-9-6(11)1-2-7(9)12/h1-2,6,11H,3-4H2,(H2,8,10).
What are the key properties of 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide?
3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide has a molecular weight of 170.17 g/mol, XLogP of -1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide is sourced from PubChem (CID 123824059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).