(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol

C20H26N2O2 — CID 95104720

IUPAC(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol
SMILESCOc1ccc([C@@H](O)CN2CCN(c3cccc(C)c3)CC2)cc1
InChIInChI=1S/C20H26N2O2/c1-16-4-3-5-18(14-16)22-12-10-21(11-13-22)15-20(23)17-6-8-19(24-2)9-7-17/h3-9,14,20,23H,10-13,15H2,1-2H3/t20-/m0/s1
InChIKeyIPFMPIMFAGBMOM-FQEVSTJZSA-N
MW326.44 g/mol
LogP2.86
Rot. Bonds5

About (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol

(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol (PubChem CID 95104720) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol
PubChem CID95104720
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol
SMILESCOc1ccc([C@@H](O)CN2CCN(c3cccc(C)c3)CC2)cc1
InChIInChI=1S/C20H26N2O2/c1-16-4-3-5-18(14-16)22-12-10-21(11-13-22)15-20(23)17-6-8-19(24-2)9-7-17/h3-9,14,20,23H,10-13,15H2,1-2H3/t20-/m0/s1
InChIKeyIPFMPIMFAGBMOM-FQEVSTJZSA-N
XLogP2.86
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol
CID 53180192
1-(2,5-dimethylphenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanol
CID 53180191
(2S)-1-(4-methylphenoxy)-3-[4-(3-methylphenyl)piperazin-1-yl]propan-2-ol
CID 92856434
(2R)-1-[4-(3-methylphenyl)piperazin-1-yl]-3-pyrrolidin-1-ylpropan-2-ol
CID 94183925
2-(azepan-1-yl)-1-(4-methoxyphenyl)ethanol
CID 54944635
(1S)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)ethanol
CID 7036660
1-[3-(4-methoxyphenyl)sulfanylpropyl]-4-(3-methylphenyl)piperazine
CID 10247707
(1R)-1-(4-ethoxyphenyl)-2-(4-phenylpiperazin-1-yl)ethanol
CID 95104653
1-(4-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)ethanol
CID 60971064
(1S)-1-(1H-indol-6-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanol
CID 92701020
2-[4-(3-chlorophenyl)piperazin-1-yl]-1-(3,4-dimethoxyphenyl)ethanol
CID 53180160
1-[4-(3-methylphenyl)piperazin-1-yl]pentan-2-ol
CID 62044767

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol?
The IUPAC name of (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol (CID 95104720) is (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol.
What is the SMILES notation for (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol?
The canonical SMILES for (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol is COc1ccc([C@@H](O)CN2CCN(c3cccc(C)c3)CC2)cc1.
What is the InChIKey of (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol?
The InChIKey is IPFMPIMFAGBMOM-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-16-4-3-5-18(14-16)22-12-10-21(11-13-22)15-20(23)17-6-8-19(24-2)9-7-17/h3-9,14,20,23H,10-13,15H2,1-2H3/t20-/m0/s1.
What are the key properties of (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol?
(1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol has a molecular weight of 326.44 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-methoxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 95104720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).