1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine

C20H26N2O — CID 10448132

IUPAC1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine
SMILESCO[C@@H](CN1CCN(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-23-20(19-10-6-3-7-11-19)17-22-14-12-21(13-15-22)16-18-8-4-2-5-9-18/h2-11,20H,12-17H2,1H3/t20-/m0/s1
InChIKeyOZLVOCNIXMRAAE-FQEVSTJZSA-N
MW310.44 g/mol
LogP3.19
Rot. Bonds6

About 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine

1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine (PubChem CID 10448132) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine.

Molecular Properties

Compound Name1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine
PubChem CID10448132
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine
SMILESCO[C@@H](CN1CCN(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-23-20(19-10-6-3-7-11-19)17-22-14-12-21(13-15-22)16-18-8-4-2-5-9-18/h2-11,20H,12-17H2,1H3/t20-/m0/s1
InChIKeyOZLVOCNIXMRAAE-FQEVSTJZSA-N
XLogP3.19
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-2-phenylethyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine
CID 171335225
1-[(2-bromophenyl)methyl]-4-(2-methoxy-2-phenylethyl)piperazine
CID 171335226
1,4-bis[2-(4-chlorophenyl)-2-methoxyethyl]piperazine
CID 167921657
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
(1S)-2-(4-benzylpiperazin-1-yl)-1-phenylethanol;dihydrochloride
CID 69054522
1-(4-benzylpiperazin-1-yl)propane-2-thiol
CID 88685831
(2R)-1-benzhydryloxy-3-(4-benzylpiperazin-1-yl)propan-2-ol
CID 7746132
1-benzhydryloxy-3-(4-benzylpiperazin-1-yl)propan-2-ol
CID 4224882
1-(4-benzylpiperazin-1-yl)-3-methylbutan-2-amine
CID 43199540
1-(4-benzylpiperazin-1-yl)butan-2-ol
CID 60885718
1-benzyl-4-[3-(2-methoxyphenoxy)-3-phenylpropyl]piperazine;hydron;dichloride
CID 50987098
1-(2-methoxy-2-phenylethyl)-4-phenyl-3,6-dihydro-2H-pyridine
CID 110177591

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine?
The IUPAC name of 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine (CID 10448132) is 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine.
What is the SMILES notation for 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine?
The canonical SMILES for 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine is CO[C@@H](CN1CCN(Cc2ccccc2)CC1)c1ccccc1.
What is the InChIKey of 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine?
The InChIKey is OZLVOCNIXMRAAE-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H26N2O/c1-23-20(19-10-6-3-7-11-19)17-22-14-12-21(13-15-22)16-18-8-4-2-5-9-18/h2-11,20H,12-17H2,1H3/t20-/m0/s1.
What are the key properties of 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine?
1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine has a molecular weight of 310.44 g/mol, XLogP of 3.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-[(2R)-2-methoxy-2-phenylethyl]piperazine is sourced from PubChem (CID 10448132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).