1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol

C26H36N2O2 — CID 151295162

IUPAC1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol
SMILESCOc1ccccc1N1CCN(CCC(c2ccccc2)C2(O)CCCCC2)CC1
InChIInChI=1S/C26H36N2O2/c1-30-25-13-7-6-12-24(25)28-20-18-27(19-21-28)17-14-23(22-10-4-2-5-11-22)26(29)15-8-3-9-16-26/h2,4-7,10-13,23,29H,3,8-9,14-21H2,1H3
InChIKeyOBGGVNLPFLZKAO-UHFFFAOYSA-N
MW408.59 g/mol
LogP4.69
Rot. Bonds7

About 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol

1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol (PubChem CID 151295162) has the molecular formula C26H36N2O2 and a molecular weight of 408.59 g/mol. Its IUPAC name is 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol
PubChem CID151295162
Molecular FormulaC26H36N2O2
Molecular Weight408.59 g/mol
Exact Mass408.28
IUPAC Name1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol
SMILESCOc1ccccc1N1CCN(CCC(c2ccccc2)C2(O)CCCCC2)CC1
InChIInChI=1S/C26H36N2O2/c1-30-25-13-7-6-12-24(25)28-20-18-27(19-21-28)17-14-23(22-10-4-2-5-11-22)26(29)15-8-3-9-16-26/h2,4-7,10-13,23,29H,3,8-9,14-21H2,1H3
InChIKeyOBGGVNLPFLZKAO-UHFFFAOYSA-N
XLogP4.69
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.59
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(4-methoxyphenyl)-3-[4-(2-methoxyphenyl)-2-methylpiperazin-1-yl]propyl]cyclohexan-1-ol
CID 67825142
8-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-8-azaspiro[4.5]decane
CID 91175369
1-cycloheptyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenylbutan-1-one
CID 15524030
2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
CID 71671571
N-[cyclohexyl(phenyl)methyl]-3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 14208395
1-[3-[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-1-(4-methoxyphenyl)propyl]cyclohexan-1-ol
CID 21241495
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenyl-N,N-bis(prop-2-ynyl)butanamide
CID 15296377
1-(2-methoxyphenyl)-4-[3-(3-methyl-5-propan-2-ylphenoxy)-3-phenylpropyl]piperazine
CID 46068807
methyl 3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenylpropanoate
CID 19433554
3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenyl-1-pyrrolidin-1-ylpropan-1-one
CID 18956031
3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
CID 10467259
3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 10849160

Frequently Asked Questions

What is the IUPAC name of 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol?
The IUPAC name of 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol (CID 151295162) is 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol?
The canonical SMILES for 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol is COc1ccccc1N1CCN(CCC(c2ccccc2)C2(O)CCCCC2)CC1.
What is the InChIKey of 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol?
The InChIKey is OBGGVNLPFLZKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H36N2O2/c1-30-25-13-7-6-12-24(25)28-20-18-27(19-21-28)17-14-23(22-10-4-2-5-11-22)26(29)15-8-3-9-16-26/h2,4-7,10-13,23,29H,3,8-9,14-21H2,1H3.
What are the key properties of 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol?
1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol has a molecular weight of 408.59 g/mol, XLogP of 4.69, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropyl]cyclohexan-1-ol is sourced from PubChem (CID 151295162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).