Basic information
- CAS
443325-68-6- Standard SMILES
O=C(NCCc1c[nH]c2ccccc12)C(=O)NCC1CCCO1- InChIKey
OSYYOPSSNWIUDH-UHFFFAOYSA-N- Molecular formula
- C17H21N3O3
- Average molar mass
- 315.37 g/mol
- Monoisotopic mass
- 315.15829154
Names & identifiers
- Preferred name
- N-[2-(1H-indol-3-yl)ethyl]-N'-(oxolan-2-ylmethyl)oxamide
- IUPAC
- N-[2-(1H-indol-3-yl)ethyl]-N'-(oxolan-2-ylmethyl)oxamide
Names & synonyms
N-[2-(1H-indol-3-yl)ethyl]-N'-(oxolan-2-ylmethyl)oxamide443325-68-6N1-(2-(1H-indol-3-yl)ethyl)-N2-((tetrahydrofuran-2-yl)methyl)oxalamideMLS000709661CHEMBL1517781N~1~-[2-(1H-Indol-3-yl)ethyl]-N~2~-[(oxolan-2-yl)methyl]ethanediamideDTXSID001330719HMS2695C14STL558648AKOS000341993AKOS022003489CCG-113807
Show more names
SMR000286528EU-0013870ST50277473AO-081/41061545SR-01000505996SR-01000505996-1Z57185703N'-(2-indol-3-ylethyl)-N-(oxolan-2-ylmethyl)ethane-1,2-diamide
Database identifiers
- CAS
443325-68-6- PubChem CID
- 2933840
- DTXSID
DTXSID001330719- ChEMBL
CHEMBL1517781
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 83.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 429
Experimental & physicochemical properties
Solubility9 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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