2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide

C10H16N2O4 — CID 10353719

IUPAC2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide
SMILESC=CCN(CC=C)C(=O)C(O)C(O)C(N)=O
InChIInChI=1S/C10H16N2O4/c1-3-5-12(6-4-2)10(16)8(14)7(13)9(11)15/h3-4,7-8,13-14H,1-2,5-6H2,(H2,11,15)
InChIKeyIMPBVNVGSKOCPI-UHFFFAOYSA-N
MW228.25 g/mol
LogP-1.61
Rot. Bonds7

About 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide

2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide (PubChem CID 10353719) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide.

Molecular Properties

Compound Name2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide
PubChem CID10353719
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide
SMILESC=CCN(CC=C)C(=O)C(O)C(O)C(N)=O
InChIInChI=1S/C10H16N2O4/c1-3-5-12(6-4-2)10(16)8(14)7(13)9(11)15/h3-4,7-8,13-14H,1-2,5-6H2,(H2,11,15)
InChIKeyIMPBVNVGSKOCPI-UHFFFAOYSA-N
XLogP-1.61
TPSA103.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 5-1.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide?
The IUPAC name of 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide (CID 10353719) is 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide.
What is the SMILES notation for 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide?
The canonical SMILES for 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide is C=CCN(CC=C)C(=O)C(O)C(O)C(N)=O.
What is the InChIKey of 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide?
The InChIKey is IMPBVNVGSKOCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c1-3-5-12(6-4-2)10(16)8(14)7(13)9(11)15/h3-4,7-8,13-14H,1-2,5-6H2,(H2,11,15).
What are the key properties of 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide?
2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide has a molecular weight of 228.25 g/mol, XLogP of -1.61, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-N',N'-bis(prop-2-enyl)butanediamide is sourced from PubChem (CID 10353719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).