1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine

C23H30N2O — CID 969469

IUPAC1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine
SMILESCOc1ccccc1N1CCN(C2CCC(c3ccccc3)CC2)CC1
InChIInChI=1S/C23H30N2O/c1-26-23-10-6-5-9-22(23)25-17-15-24(16-18-25)21-13-11-20(12-14-21)19-7-3-2-4-8-19/h2-10,20-21H,11-18H2,1H3
InChIKeyLHDBCFYGEHRWTM-UHFFFAOYSA-N
MW350.51 g/mol
LogP4.54
Rot. Bonds4

About 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine

1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine (PubChem CID 969469) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine
PubChem CID969469
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine
SMILESCOc1ccccc1N1CCN(C2CCC(c3ccccc3)CC2)CC1
InChIInChI=1S/C23H30N2O/c1-26-23-10-6-5-9-22(23)25-17-15-24(16-18-25)21-13-11-20(12-14-21)19-7-3-2-4-8-19/h2-10,20-21H,11-18H2,1H3
InChIKeyLHDBCFYGEHRWTM-UHFFFAOYSA-N
XLogP4.54
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine?
The IUPAC name of 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine (CID 969469) is 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine.
What is the SMILES notation for 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine?
The canonical SMILES for 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine is COc1ccccc1N1CCN(C2CCC(c3ccccc3)CC2)CC1.
What is the InChIKey of 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine?
The InChIKey is LHDBCFYGEHRWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-26-23-10-6-5-9-22(23)25-17-15-24(16-18-25)21-13-11-20(12-14-21)19-7-3-2-4-8-19/h2-10,20-21H,11-18H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine?
1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine has a molecular weight of 350.51 g/mol, XLogP of 4.54, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-4-(4-phenylcyclohexyl)piperazine is sourced from PubChem (CID 969469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).