1-methyl-4-(2-phenylmethoxyphenyl)piperazine

C18H22N2O — CID 58996693

IUPAC1-methyl-4-(2-phenylmethoxyphenyl)piperazine
SMILESCN1CCN(c2ccccc2OCc2ccccc2)CC1
InChIInChI=1S/C18H22N2O/c1-19-11-13-20(14-12-19)17-9-5-6-10-18(17)21-15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3
InChIKeyFMZBRJUSIIVEJL-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.02
Rot. Bonds4

About 1-methyl-4-(2-phenylmethoxyphenyl)piperazine

1-methyl-4-(2-phenylmethoxyphenyl)piperazine (PubChem CID 58996693) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-methyl-4-(2-phenylmethoxyphenyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(2-phenylmethoxyphenyl)piperazine
PubChem CID58996693
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name1-methyl-4-(2-phenylmethoxyphenyl)piperazine
SMILESCN1CCN(c2ccccc2OCc2ccccc2)CC1
InChIInChI=1S/C18H22N2O/c1-19-11-13-20(14-12-19)17-9-5-6-10-18(17)21-15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3
InChIKeyFMZBRJUSIIVEJL-UHFFFAOYSA-N
XLogP3.02
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-[2-[(3-nitrophenyl)methoxy]phenyl]piperazine
CID 67725452
1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine
CID 58996743
1-methyl-4-[2-(2-pyrrolidin-1-ylethoxy)phenyl]piperazine
CID 58817389
8-(4-methylpiperazin-1-yl)-5-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline
CID 58794198
N-benzyl-3-(4-methylpiperazin-1-yl)-2-phenylmethoxyaniline
CID 134080591
3-(4-methylpiperazin-1-yl)-5-phenylmethoxyquinoline
CID 50994942
1-(2-methoxyphenyl)-4-[3-(4-phenylmethoxyphenoxy)propyl]piperazine
CID 139690645
1-(4-bromo-2-methyl-6-phenylmethoxyphenyl)-4-methylpiperazine
CID 150465716
1-(2-ethoxyphenyl)-4-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperazine
CID 2846107
1-methyl-4-[2-(trifluoromethoxy)phenyl]piperazine
CID 167238583
1-[(2-bromo-3-phenylmethoxyphenyl)methyl]-4-methylpiperazine
CID 172648016
(9aR)-8-(2-phenylmethoxyphenyl)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine
CID 171782007

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-phenylmethoxyphenyl)piperazine?
The IUPAC name of 1-methyl-4-(2-phenylmethoxyphenyl)piperazine (CID 58996693) is 1-methyl-4-(2-phenylmethoxyphenyl)piperazine.
What is the SMILES notation for 1-methyl-4-(2-phenylmethoxyphenyl)piperazine?
The canonical SMILES for 1-methyl-4-(2-phenylmethoxyphenyl)piperazine is CN1CCN(c2ccccc2OCc2ccccc2)CC1.
What is the InChIKey of 1-methyl-4-(2-phenylmethoxyphenyl)piperazine?
The InChIKey is FMZBRJUSIIVEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-19-11-13-20(14-12-19)17-9-5-6-10-18(17)21-15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3.
What are the key properties of 1-methyl-4-(2-phenylmethoxyphenyl)piperazine?
1-methyl-4-(2-phenylmethoxyphenyl)piperazine has a molecular weight of 282.39 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-phenylmethoxyphenyl)piperazine is sourced from PubChem (CID 58996693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).