1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine

C24H30N2O2 — CID 11003366

IUPAC1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine
SMILESCOc1cccc(C2=CCC(N3CCN(c4ccccc4OC)CC3)CC2)c1
InChIInChI=1S/C24H30N2O2/c1-27-22-7-5-6-20(18-22)19-10-12-21(13-11-19)25-14-16-26(17-15-25)23-8-3-4-9-24(23)28-2/h3-10,18,21H,11-17H2,1-2H3
InChIKeyWNELYPHBVMGNQP-UHFFFAOYSA-N
MW378.52 g/mol
LogP4.46
Rot. Bonds5

About 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine

1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine (PubChem CID 11003366) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine
PubChem CID11003366
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC Name1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine
SMILESCOc1cccc(C2=CCC(N3CCN(c4ccccc4OC)CC3)CC2)c1
InChIInChI=1S/C24H30N2O2/c1-27-22-7-5-6-20(18-22)19-10-12-21(13-11-19)25-14-16-26(17-15-25)23-8-3-4-9-24(23)28-2/h3-10,18,21H,11-17H2,1-2H3
InChIKeyWNELYPHBVMGNQP-UHFFFAOYSA-N
XLogP4.46
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine?
The IUPAC name of 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine (CID 11003366) is 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine.
What is the SMILES notation for 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine?
The canonical SMILES for 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine is COc1cccc(C2=CCC(N3CCN(c4ccccc4OC)CC3)CC2)c1.
What is the InChIKey of 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine?
The InChIKey is WNELYPHBVMGNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c1-27-22-7-5-6-20(18-22)19-10-12-21(13-11-19)25-14-16-26(17-15-25)23-8-3-4-9-24(23)28-2/h3-10,18,21H,11-17H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine?
1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine has a molecular weight of 378.52 g/mol, XLogP of 4.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-4-[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]piperazine is sourced from PubChem (CID 11003366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).