Basic information
- CAS
1248439-39-5- Standard SMILES
CCNC(=O)C(CN)Cc1cccnc1- InChIKey
XLIPJTATBMHNGV-UHFFFAOYSA-N- Molecular formula
- C11H17N3O
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.13716217
Names & identifiers
- Preferred name
- I+/--(Aminomethyl)-N-ethyl-3-pyridinepropanamide
- IUPAC
- 2-(aminomethyl)-N-ethyl-3-pyridin-3-ylpropanamide
Names & synonyms
DTXSID401251886AKOS011374737I+/--(Aminomethyl)-N-ethyl-3-pyridinepropanamide2-(Aminomethyl)-N-ethyl-3-(pyridin-3-yl)propanamide1248439-39-5
Database identifiers
- CAS
1248439-39-5- PubChem CID
- 62095438
- DTXSID
DTXSID401251886
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 196
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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