Piperidine, 3-methyl-1-(3-(p-(phenoxymethyl)phenyl)propyl)-

HCID 3064321

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Basic information

CAS: 102071-38-5
Standard SMILES: CC1CCCN(CCCc2ccc(COc3ccccc3)cc2)C1
InChIKey: LXUUXKGMRVAFEX-UHFFFAOYSA-N
Molecular formula: C22H29NO
Average molar mass: 323.5 g/mol
Monoisotopic mass: 323.22491455

Names & identifiers

Preferred name: Piperidine, 3-methyl-1-(3-(p-(phenoxymethyl)phenyl)propyl)-
IUPAC: 3-methyl-1-[3-[4-(phenoxymethyl)phenyl]propyl]piperidine

Names & synonyms

BRN 02895993-Methyl-1-(3-(p-(phenoxymethyl)phenyl)propyl)piperidine102071-38-5Piperidine, 3-methyl-1-(3-(p-(phenoxymethyl)phenyl)propyl)-4-20-00-01503 (Beilstein Handbook Reference)RefChem:373263DTXSID409070443-METHYL-1-{3-[4-(PHENOXYMETHYL)PHENYL]PROPYL}PIPERIDINE

Database identifiers

CAS: 102071-38-5
PubChem CID: 3064321
DTXSID: DTXSID40907044
Nikkaji: J77.441C

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 7
Heavy atoms: 24
Formal charge: 0
Complexity: 331

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