2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride

C13H22Cl2N2O2 — CID 71671571

IUPAC2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
SMILESCOc1ccccc1N1CCN(CCO)CC1.Cl.Cl
InChIInChI=1S/C13H20N2O2.2ClH/c1-17-13-5-3-2-4-12(13)15-8-6-14(7-9-15)10-11-16;;/h2-5,16H,6-11H2,1H3;2*1H
InChIKeyAWONCLGFKLZVPN-UHFFFAOYSA-N
MW309.24 g/mol
LogP1.65
Rot. Bonds4

About 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride

2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride (PubChem CID 71671571) has the molecular formula C13H22Cl2N2O2 and a molecular weight of 309.24 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride.

Molecular Properties

Compound Name2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
PubChem CID71671571
Molecular FormulaC13H22Cl2N2O2
Molecular Weight309.24 g/mol
Exact Mass308.11
IUPAC Name2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
SMILESCOc1ccccc1N1CCN(CCO)CC1.Cl.Cl
InChIInChI=1S/C13H20N2O2.2ClH/c1-17-13-5-3-2-4-12(13)15-8-6-14(7-9-15)10-11-16;;/h2-5,16H,6-11H2,1H3;2*1H
InChIKeyAWONCLGFKLZVPN-UHFFFAOYSA-N
XLogP1.65
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.24
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-4-[2-(triazol-2-yl)ethyl]piperazine
CID 155941923
3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
CID 10467259
3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 10849160
1-(chloromethyl)-4-(2-methoxyphenyl)piperazine
CID 19434771
1-(2-methoxyphenyl)-4-pent-4-ynylpiperazine
CID 112548439
8-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-8-azaspiro[4.5]decane
CID 91175369
3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpropane-1,2-diol
CID 166286980
4-[4-(2-methoxyphenyl)piperazin-1-yl]butanenitrile
CID 586071
2-methoxy-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]aniline
CID 22458185
1-(2-hydroxyethyl)-3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinazoline-2,4-dione
CID 13387788
1-amino-4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylbutan-2-ol
CID 64819623
2-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]phenyl]acetic acid
CID 174365848

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride?
The IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride (CID 71671571) is 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride.
What is the SMILES notation for 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride?
The canonical SMILES for 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride is COc1ccccc1N1CCN(CCO)CC1.Cl.Cl.
What is the InChIKey of 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride?
The InChIKey is AWONCLGFKLZVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2.2ClH/c1-17-13-5-3-2-4-12(13)15-8-6-14(7-9-15)10-11-16;;/h2-5,16H,6-11H2,1H3;2*1H.
What are the key properties of 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride?
2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride has a molecular weight of 309.24 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride is sourced from PubChem (CID 71671571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).