1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol

C14H22N2O2 — CID 43592199

IUPAC1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol
SMILESCC(O)c1ccccc1N1CCN(CCO)CC1
InChIInChI=1S/C14H22N2O2/c1-12(18)13-4-2-3-5-14(13)16-8-6-15(7-9-16)10-11-17/h2-5,12,17-18H,6-11H2,1H3
InChIKeyPYRHENVOYRMTRB-UHFFFAOYSA-N
MW250.34 g/mol
LogP0.85
Rot. Bonds4

About 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol

1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol (PubChem CID 43592199) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol.

Molecular Properties

Compound Name1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol
PubChem CID43592199
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol
SMILESCC(O)c1ccccc1N1CCN(CCO)CC1
InChIInChI=1S/C14H22N2O2/c1-12(18)13-4-2-3-5-14(13)16-8-6-15(7-9-16)10-11-17/h2-5,12,17-18H,6-11H2,1H3
InChIKeyPYRHENVOYRMTRB-UHFFFAOYSA-N
XLogP0.85
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol?
The IUPAC name of 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol (CID 43592199) is 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol.
What is the SMILES notation for 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol?
The canonical SMILES for 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol is CC(O)c1ccccc1N1CCN(CCO)CC1.
What is the InChIKey of 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol?
The InChIKey is PYRHENVOYRMTRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-12(18)13-4-2-3-5-14(13)16-8-6-15(7-9-16)10-11-17/h2-5,12,17-18H,6-11H2,1H3.
What are the key properties of 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol?
1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol has a molecular weight of 250.34 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol is sourced from PubChem (CID 43592199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).