1-benzyl-N-(pentan-3-yl)piperidin-4-amine
Basic information
- CAS
423738-91-4- Standard SMILES
CCC(CC)NC1CCN(Cc2ccccc2)CC1- InChIKey
IILFGFGHMFLZQH-UHFFFAOYSA-N- Molecular formula
- C17H28N2
- Average molar mass
- 260.4 g/mol
- Monoisotopic mass
- 260.2252489
Names & identifiers
- Preferred name
- 1-benzyl-N-(pentan-3-yl)piperidin-4-amine
- IUPAC
- 1-benzyl-N-pentan-3-ylpiperidin-4-amine
- English name
- CHEMBRDG-BB 5938636
- Molecular formula
- C17H28N2
- Molecular weight
- 260.42
Names & synonyms
423738-91-41-benzyl-N-(pentan-3-yl)piperidin-4-amine1-benzyl-N-pentan-3-ylpiperidin-4-amine1-BENZYL-N-(1-ETHYLPROPYL)PIPERIDIN-4-AMINEHMS1681M01Oprea1_295933Oprea1_432489DTXSID70354941STK128825AKOS000237414(ethylpropyl)[1-benzyl(4-piperidyl)]amineDB-211186
Show more names
CHEMBRDG-BB 59386364-Piperidinamine, N-(1-ethylpropyl)-1-(phenylmethyl)-1-benzyl-N-(1-ethylpropyl)piperidin-4-amine(SALTDATA: 2HBr)
ST45110611EN300-713629AT-057/43316148N-(1-benzyl-4-piperidinyl)-N-(1-ethylpropyl)amine1-benzyl-N-(pentan-3-yl)piperidin-4-amine--oxalic acid (1/1)
Database identifiers
- CAS
423738-91-4- PubChem CID
- 787229
- DTXSID
DTXSID70354941
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- Boiling point
- 352.4 · 352.4±35.0 °C(Predicted)
- Density
- 0.97 · 0.97±0.1 g/cm3(Predicted)
- pka
- 10.66 · 10.66±0.20(Predicted)
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Compound notes
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