| CAS Number | 915922-00-8 |
| Catalog Number | AG00GTT8(AGN-PC-0WB3IT) |
| Chemical Name | N-[(3-Ethyl-1,2,4-oxadiazol-5-YL)methyl]propan-2-amine |
| IUPAC Name | N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine |
| InChI | InChI=1S/C8H15N3O/c1-4-7-10-8(12-11-7)5-9-6(2)3/h6,9H,4-5H2,1-3H3 |
| InChI Key | IDWQREWRKBJTBS-UHFFFAOYSA-N |
| MDL Number | MFCD08691559 |
| Molecular Formula | C8H15N3O |
| Molecular Weight | 169.2242 |
| SMILES | N1C(CC)=NOC=1CNC(C)C |
| Synonyms | 915922-00-8,
N-[(3-ETHYL-1,2,4-OXADIAZOL-5-YL)METHYL]PROPAN-2-AMINE,
N-((3-Ethyl-1,2,4-oxadiazol-5-yl)methyl)propan-2-amine,
CHEMBRDG-BB 4012582,
SCHEMBL9963365,
CTK5H0012,
DTXSID70650859,
ZX-CM003985,
MFCD08691559,
ZINC19089786,
AKOS009132222,
AJ-71268,
BBV-29349079,
Y-4231,
N-[(3-Ethyl-1,2,4-oxadiazol-5-yl)methyl]-2-propanamine,
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| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.228g/mol |
| Monoisotopic Mass | 169.122g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number