Homoquisqualamine
Basic information
- CAS
158923-63-8- Standard SMILES
NCCCn1oc(=O)[nH]c1=O- InChIKey
RCGQEYVSADAATR-UHFFFAOYSA-N- Molecular formula
- C5H9N3O3
- Average molar mass
- 159.14 g/mol
- Monoisotopic mass
- 159.06439116
Overview
structure given in first source
Names & identifiers
- Preferred name
- Homoquisqualamine
- IUPAC
- 2-(3-aminopropyl)-1,2,4-oxadiazolidine-3,5-dione
- English name
- homoquisqualamine
- Molecular formula
- C5H9N3O3
- Molecular weight
- 159.14
Names & synonyms
HomoquisqualamineHomoquam158923-63-81,2,4-Oxadiazolidine-3,5-dione, 2-(3-aminopropyl)-DTXSID30166542RefChem:146766DTXCID30890332-(3-aminopropyl)-1,2,4-oxadiazolidine-3,5-dione
Database identifiers
- CAS
158923-63-8- PubChem CID
- 190935
- DTXSID
DTXSID30166542
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 182
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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