2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide

C6H11NO3 — CID 88641851

IUPAC2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide
SMILESC=CC(O)NC(=O)C(C)O
InChIInChI=1S/C6H11NO3/c1-3-5(9)7-6(10)4(2)8/h3-5,8-9H,1H2,2H3,(H,7,10)
InChIKeyVTLQBDSNRAVDJC-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.01
Rot. Bonds3

About 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide

2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide (PubChem CID 88641851) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide.

Molecular Properties

Compound Name2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide
PubChem CID88641851
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide
SMILESC=CC(O)NC(=O)C(C)O
InChIInChI=1S/C6H11NO3/c1-3-5(9)7-6(10)4(2)8/h3-5,8-9H,1H2,2H3,(H,7,10)
InChIKeyVTLQBDSNRAVDJC-UHFFFAOYSA-N
XLogP-1.01
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide?
The IUPAC name of 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide (CID 88641851) is 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide.
What is the SMILES notation for 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide?
The canonical SMILES for 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide is C=CC(O)NC(=O)C(C)O.
What is the InChIKey of 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide?
The InChIKey is VTLQBDSNRAVDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-3-5(9)7-6(10)4(2)8/h3-5,8-9H,1H2,2H3,(H,7,10).
What are the key properties of 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide?
2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide has a molecular weight of 145.16 g/mol, XLogP of -1.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1-hydroxyprop-2-enyl)propanamide is sourced from PubChem (CID 88641851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).