N-(2-pyridin-3-ylethyl)butan-1-amine
Basic information
- CAS
5415-00-9- Standard SMILES
CCCCNCCc1cccnc1- InChIKey
SRXNPALIQUBFLS-UHFFFAOYSA-N- Molecular formula
- C11H18N2
- Average molar mass
- 178.27 g/mol
- Monoisotopic mass
- 178.14699858
Names & identifiers
- Preferred name
- N-(2-pyridin-3-ylethyl)butan-1-amine
- IUPAC
- N-(2-pyridin-3-ylethyl)butan-1-amine
Names & synonyms
5415-00-9N-(2-pyridin-3-ylethyl)butan-1-amineN-[2-(3-Pyridinyl)ethyl]-1-butanaminen-[2-(pyridin-3-yl)ethyl]butan-1-amineNSC11009DTXSID30279005NSC-11009
Database identifiers
- CAS
5415-00-9- PubChem CID
- 223387
- DTXSID
DTXSID30279005
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 115
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Compound notes
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