1-Naphthaleneacetamide, alpha-(sec-butyl)-alpha-(2-piperidinoethyl)-
Basic information
- CAS
1944-72-5- Standard SMILES
CC(C)CC(CCN1CCCCC1)(C(N)=O)c1cccc2ccccc12- InChIKey
PZQTXTIYSVTHQD-UHFFFAOYSA-N- Molecular formula
- C23H32N2O
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.25146365
Names & identifiers
- Preferred name
- 1-Naphthaleneacetamide, alpha-(sec-butyl)-alpha-(2-piperidinoethyl)-
- IUPAC
- 4-methyl-2-naphthalen-1-yl-2-(2-piperidin-1-ylethyl)pentanamide
- English name
- α-sec-Butyl-α-(1-naphtyl)-1-piperidinebutyramide
- Molecular formula
- C23H32N2O
- Molecular weight
- 352.52
Names & synonyms
BRN 1266613alpha-(sec-Butyl)-alpha-(2-piperidinoethyl)-1-naphthylacetamide1944-72-5Valeramide, 3-methyl-2-(1-naphthyl)-2-(2-piperidinoethyl)-1-Naphthaleneacetamide, alpha-(sec-butyl)-alpha-(2-piperidinoethyl)-RefChem:2321894-methyl-2-naphthalen-1-yl-2-(2-piperidin-1-ylethyl)pentanamideDTXSID509411764-Methyl-2-(naphthalen-1-yl)-2-[2-(piperidin-1-yl)ethyl]pentanimidic acidα-sec-Butyl-α-(1-naphtyl)-1-piperidinebutyramide1-Piperidinebutanamide, α-(1-methylpropyl)-α-1-naphthalenyl-
Database identifiers
- CAS
1944-72-5- PubChem CID
- 102726
- DTXSID
DTXSID50941176
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 457
Physicochemical properties
- Melting point
- 164 · 164-165 °C
- Boiling point
- 556.5 · 556.5±50.0 °C(Predicted)
- Density
- 1.065 · 1.065±0.06 g/cm3(Predicted)
- pka
- 16.21 · 16.21±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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