Basic information
- CAS
33310-57-5- Standard SMILES
CC(C)CC(C=NCC(CCN1CCCC1)(CC(C)C)c1cccc2ccccc12)(CCN1CCCC1)c1cccc2ccccc12- InChIKey
RNIOMIKFOZKIOD-UHFFFAOYSA-N- Molecular formula
- C44H59N3
- Average molar mass
- 630 g/mol
- Monoisotopic mass
- 629.47089889
Names & identifiers
- Preferred name
- 4-Methyl-N-(4-methyl-2-(naphthalen-1-yl)-2-(2-(pyrrolidin-1-yl)ethyl)pentyl)-2-(naphthalen-1-yl)-2-(2-(pyrrolidin-1-yl)ethyl)pentan-1-imine
- IUPAC
- 4-methyl-N-[4-methyl-2-naphthalen-1-yl-2-(2-pyrrolidin-1-ylethyl)pentyl]-2-naphthalen-1-yl-2-(2-pyrrolidin-1-ylethyl)pentan-1-imine
- English name
- N-[4-Methyl-2-(1-naphtyl)-2-(2-pyrrolizinoethyl)amyl]-4-methyl-2-(1-naphtyl)-2-(2-pyrrolizinoethyl)-1-pentanimine
- Molecular formula
- C44H59N3
- Molecular weight
- 629.95936
Names & synonyms
DTXSID909549424-Methyl-N-(4-methyl-2-(naphthalen-1-yl)-2-(2-(pyrrolidin-1-yl)ethyl)pentyl)-2-(naphthalen-1-yl)-2-(2-(pyrrolidin-1-yl)ethyl)pentan-1-imine4-Methyl-N-{4-methyl-2-(naphthalen-1-yl)-2-[2-(pyrrolidin-1-yl)ethyl]pentyl}-2-(naphthalen-1-yl)-2-[2-(pyrrolidin-1-yl)ethyl]pentan-1-imineRefChem:1071134DTXCID10138294933310-57-5Pyrrolidine, 1-(5-methyl-3-(N-(4-methyl-2-(1-naphthyl)-2-(2-(1-pyrrolidinyl)ethyl)pentyl)formimidoyl)-3-(1-naphthyl)hexyl)-Pyrrolidine, 1-[5-methyl-3-[N-[4-methyl-2-(1-naphthyl)-2-[2-(1-pyrrolidinyl)ethyl]pentyl]formimidoyl]-3-(1-naphthyl)hexyl]-NSC 171419NSC171419Pyrrolidine, 1,1'-(delta,delta'-nitriloditetramethylene)bis(gamma-isobutyl-gamma-(1-naphthyl)-NSC-171419
Show more names
1-Pyrrolidinebutanamine, N-[4-methyl-2-(1-naphthalenyl)-2-[2-(1-pyrrolidinyl)ethyl]pentylidene]-β-(2-methylpropyl)-β-1-naphthalenyl-
WLN: L66J BX1Y1&1&2- AT5NTJ&1UN1X1Y1&1&2- AT5NTJ&- BL66JN-[4-Methyl-2-(1-naphtyl)-2-(2-pyrrolizinoethyl)amyl]-4-methyl-2-(1-naphtyl)-2-(2-pyrrolizinoethyl)-1-pentaniminePyrrolidine,1'-(.delta.,.delta.'-nitriloditetramethylene)bis(.gamma.-isobutyl-.gamma.-(1-naphthyl)-
Database identifiers
- CAS
33310-57-5- PubChem CID
- 99082
- DTXSID
DTXSID90954942- Nikkaji
- J107.005C
Properties
Computed structural properties
- XLogP
- 10.7
- Topological polar surface area
- 18.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 15
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 946
Physicochemical properties
- Boiling point
- 751.5 · 751.5±60.0 °C(Predicted)
- Density
- 1.04 · 1.04±0.1 g/cm3(Predicted)
- pka
- 10.7 · 10.70±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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