1-benzyl-4-phenylmethoxypiperazine

C18H22N2O — CID 142689173

IUPAC1-benzyl-4-phenylmethoxypiperazine
SMILESc1ccc(CON2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C18H22N2O/c1-3-7-17(8-4-1)15-19-11-13-20(14-12-19)21-16-18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKeyURFNJRUYOUGMCE-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.94
Rot. Bonds5

About 1-benzyl-4-phenylmethoxypiperazine

1-benzyl-4-phenylmethoxypiperazine (PubChem CID 142689173) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-benzyl-4-phenylmethoxypiperazine.

Molecular Properties

Compound Name1-benzyl-4-phenylmethoxypiperazine
PubChem CID142689173
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name1-benzyl-4-phenylmethoxypiperazine
SMILESc1ccc(CON2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C18H22N2O/c1-3-7-17(8-4-1)15-19-11-13-20(14-12-19)21-16-18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKeyURFNJRUYOUGMCE-UHFFFAOYSA-N
XLogP2.94
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Benzylpiperazino)-1-phenyl-1-ethanol
CID 2767001
N-tert-Butyl-N-(2-methyl-1-phenylpropyl)-O-(1-phenylethyl)hydroxylamine
CID 6712809
1-Benzyl-4-(phenylmethoxymethyl)piperidine;hydrochloride
CID 45262132
1-Benzyl-4-[3-(3-phenylpropoxy)propyl]piperazine
CID 155526307
N-benzyloxy-1-methyl-2,6-diphenyl-piperidin-4-imine
CID 338334
1-Benzyl-1-(2-phenylmethoxyethyl)piperidin-1-ium
CID 4085841
1-Benzyl-4-((benzyloxy)methyl)piperidine
CID 10063111
1-Benzyl-1-(2-phenylmethoxyethyl)piperidin-1-ium chloride
CID 45488228
(2R,6S)-1-allyl-N-benzyloxy-2,6-diphenyl-piperidin-4-imine
CID 71458655
1-[[4-(Phenylmethoxymethyl)phenyl]methyl]piperidine
CID 49823767
N-[(4-fluorophenyl)methyl]-2-phenyl-N-phenylmethoxyethanamine
CID 15880805
1,4-bis(1-hydroxy-3H-2,1-benzoxaborol-3-yl)piperazine
CID 86573308

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-phenylmethoxypiperazine?
The IUPAC name of 1-benzyl-4-phenylmethoxypiperazine (CID 142689173) is 1-benzyl-4-phenylmethoxypiperazine.
What is the SMILES notation for 1-benzyl-4-phenylmethoxypiperazine?
The canonical SMILES for 1-benzyl-4-phenylmethoxypiperazine is c1ccc(CON2CCN(Cc3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzyl-4-phenylmethoxypiperazine?
The InChIKey is URFNJRUYOUGMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-3-7-17(8-4-1)15-19-11-13-20(14-12-19)21-16-18-9-5-2-6-10-18/h1-10H,11-16H2.
What are the key properties of 1-benzyl-4-phenylmethoxypiperazine?
1-benzyl-4-phenylmethoxypiperazine has a molecular weight of 282.39 g/mol, XLogP of 2.94, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-phenylmethoxypiperazine is sourced from PubChem (CID 142689173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).