4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine

C28H33NO — CID 10046504

IUPAC4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine
SMILESc1ccc(CCN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C28H33NO/c1-4-10-24(11-5-1)16-20-29-21-17-25(18-22-29)19-23-30-28(26-12-6-2-7-13-26)27-14-8-3-9-15-27/h1-15,25,28H,16-23H2
InChIKeyDIJPZEMOTICHOE-UHFFFAOYSA-N
MW399.58 g/mol
LogP6.14
Rot. Bonds9

About 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine

4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine (PubChem CID 10046504) has the molecular formula C28H33NO and a molecular weight of 399.58 g/mol. Its IUPAC name is 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine.

Molecular Properties

Compound Name4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine
PubChem CID10046504
Molecular FormulaC28H33NO
Molecular Weight399.58 g/mol
Exact Mass399.26
IUPAC Name4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine
SMILESc1ccc(CCN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C28H33NO/c1-4-10-24(11-5-1)16-20-29-21-17-25(18-22-29)19-23-30-28(26-12-6-2-7-13-26)27-14-8-3-9-15-27/h1-15,25,28H,16-23H2
InChIKeyDIJPZEMOTICHOE-UHFFFAOYSA-N
XLogP6.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.58
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[bis(4-bromophenyl)methoxy]ethyl]-1-(3-phenylpropyl)piperidine
CID 10507287
4-[2-[bis(4-methoxyphenyl)methoxy]ethyl]-1-(3-phenylpropyl)piperidine
CID 11798707
1-(2-benzhydryloxyethyl)-4-benzylpiperidine
CID 127026610
1,4-bis(2-phenylethyl)piperidine
CID 86059939
3-[4-(2-benzhydryloxyethyl)piperidin-1-yl]-1-(furan-2-yl)propan-1-one
CID 170859253
1-benzyl-4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperidine
CID 10025195
4-(2-benzhydryloxyethyl)-1-[(1-methylpyrazol-4-yl)methyl]piperidine
CID 44529538
1-[2-[(2-chlorophenyl)-phenylmethoxy]ethyl]-4-(2-phenylethyl)piperazine
CID 131880421
4-[2-[bis(4-fluorophenyl)methoxy]ethyl]-1-[(3R)-3-phenylbutyl]piperidine
CID 11628203
4-[2-[(4-fluorophenyl)-thiophen-2-ylmethoxy]ethyl]-1-(3-phenylpropyl)piperidine
CID 10812888
4-(2-benzhydryloxyethyl)-1-(naphthalen-1-ylmethyl)piperidine
CID 101165281
4-(benzhydryloxymethyl)-1-[2-(4-methoxyphenyl)ethyl]piperidine;tritiomethane
CID 159926566

Frequently Asked Questions

What is the IUPAC name of 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine?
The IUPAC name of 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine (CID 10046504) is 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine.
What is the SMILES notation for 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine?
The canonical SMILES for 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine is c1ccc(CCN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1.
What is the InChIKey of 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine?
The InChIKey is DIJPZEMOTICHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33NO/c1-4-10-24(11-5-1)16-20-29-21-17-25(18-22-29)19-23-30-28(26-12-6-2-7-13-26)27-14-8-3-9-15-27/h1-15,25,28H,16-23H2.
What are the key properties of 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine?
4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine has a molecular weight of 399.58 g/mol, XLogP of 6.14, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine is sourced from PubChem (CID 10046504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).