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Basic information
- CAS
944907-23-7- Standard SMILES
CC(C)c1nnc(CCN)o1- InChIKey
LAUHQZLJBFOKQI-UHFFFAOYSA-N- Molecular formula
- C7H13N3O
- Average molar mass
- 155.2 g/mol
- Monoisotopic mass
- 155.10586204
Names & identifiers
- Preferred name
- 2-(5-Isopropyl-1,3,4-oxadiazol-2-YL)ethanamine
- IUPAC
- 2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethanamine
Names & synonyms
944907-23-72-(5-ISOPROPYL-1,3,4-OXADIAZOL-2-YL)ETHANAMINE2-(5-Isopropyl-1,3,4-oxadiazol-2-yl)ethan-1-amineSCHEMBL1786847LAUHQZLJBFOKQI-UHFFFAOYSA-NDTXSID401240970AKOS011350117AB54547DB-3377025-(1-Methylethyl)-1,3,4-oxadiazole-2-ethanamine2-(5-isopropyl-[1,3,4]oxadiazol-2-yl)-ethylamine2-[5-(PROPAN-2-YL)-1,3,4-OXADIAZOL-2-YL]ETHAN-1-AMINE
Database identifiers
- CAS
944907-23-7- PubChem CID
- 24254483
- DTXSID
DTXSID401240970
Properties
Computed structural propertiesFilling in
- XLogP
- 0.3
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 118
Related reactions
4 records
Compound notes
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