2,3-dihydroxy-N-prop-2-enylpropanamide

C6H11NO3 — CID 87997467

IUPAC2,3-dihydroxy-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(O)CO
InChIInChI=1S/C6H11NO3/c1-2-3-7-6(10)5(9)4-8/h2,5,8-9H,1,3-4H2,(H,7,10)
InChIKeyUEWQAGHVGOUTOS-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.36
Rot. Bonds4

About 2,3-dihydroxy-N-prop-2-enylpropanamide

2,3-dihydroxy-N-prop-2-enylpropanamide (PubChem CID 87997467) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2,3-dihydroxy-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2,3-dihydroxy-N-prop-2-enylpropanamide
PubChem CID87997467
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2,3-dihydroxy-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(O)CO
InChIInChI=1S/C6H11NO3/c1-2-3-7-6(10)5(9)4-8/h2,5,8-9H,1,3-4H2,(H,7,10)
InChIKeyUEWQAGHVGOUTOS-UHFFFAOYSA-N
XLogP-1.36
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N,N'-bis(prop-2-enyl)propanediamide
CID 59934483
(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxy-N-prop-2-enylhexanamide
CID 22084455
2-methyl-N-prop-2-enylpropanamide;dihydrochloride
CID 174572104
2-hydroxy-3-[[1-oxo-1-(prop-2-enylamino)propan-2-yl]amino]propanamide
CID 106174665
2-methyl-N-prop-2-enylbutanamide
CID 20811204
(2R)-2-methyl-N-prop-2-enylbutanamide
CID 55303611
(2S)-2-chloro-N-prop-2-enylpropanamide
CID 14203945
2-methoxy-N-prop-2-enylpropanamide
CID 100983783
2-[4-(1-hydroxyethyl)piperidin-1-yl]-N-prop-2-enylpropanamide
CID 56787482
2,3-dimethyl-4-oxo-4-(prop-2-enylamino)butanoic acid
CID 58883098
2-(2-chloroethyl)-N,N'-bis(prop-2-enyl)propanediamide
CID 126612629
[1-oxo-1-(prop-2-enylamino)but-3-en-2-yl] formate
CID 173049025

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-N-prop-2-enylpropanamide?
The IUPAC name of 2,3-dihydroxy-N-prop-2-enylpropanamide (CID 87997467) is 2,3-dihydroxy-N-prop-2-enylpropanamide.
What is the SMILES notation for 2,3-dihydroxy-N-prop-2-enylpropanamide?
The canonical SMILES for 2,3-dihydroxy-N-prop-2-enylpropanamide is C=CCNC(=O)C(O)CO.
What is the InChIKey of 2,3-dihydroxy-N-prop-2-enylpropanamide?
The InChIKey is UEWQAGHVGOUTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-2-3-7-6(10)5(9)4-8/h2,5,8-9H,1,3-4H2,(H,7,10).
What are the key properties of 2,3-dihydroxy-N-prop-2-enylpropanamide?
2,3-dihydroxy-N-prop-2-enylpropanamide has a molecular weight of 145.16 g/mol, XLogP of -1.36, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-N-prop-2-enylpropanamide is sourced from PubChem (CID 87997467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).