2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol

C15H24N2O2 — CID 61210767

IUPAC2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1cccc(C(CO)N2CCNCC2)c1
InChIInChI=1S/C15H24N2O2/c1-12(2)19-14-5-3-4-13(10-14)15(11-18)17-8-6-16-7-9-17/h3-5,10,12,15-16,18H,6-9,11H2,1-2H3
InChIKeyUHKLDZWFJLOUKR-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.41
Rot. Bonds5

About 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol

2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol (PubChem CID 61210767) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol
PubChem CID61210767
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1cccc(C(CO)N2CCNCC2)c1
InChIInChI=1S/C15H24N2O2/c1-12(2)19-14-5-3-4-13(10-14)15(11-18)17-8-6-16-7-9-17/h3-5,10,12,15-16,18H,6-9,11H2,1-2H3
InChIKeyUHKLDZWFJLOUKR-UHFFFAOYSA-N
XLogP1.41
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[(1S)-2-hydroxy-1-piperazin-1-ylethyl]phenyl] acetate;hydrochloride
CID 171183093
(2R)-2-(3-ethoxyphenyl)-2-piperazin-1-ylethanol
CID 93471023
2-(1,4-diazepan-1-yl)-2-(3-ethoxyphenyl)ethanol
CID 61048843
(2S)-2-(3,5-dimethoxyphenyl)-2-piperazin-1-ylethanol
CID 93471010
methyl 3-[(1S)-2-hydroxy-1-piperazin-1-ylethyl]benzoate
CID 171183224
1-[(1S)-1-[3-(difluoromethoxy)phenyl]-2-fluoroethyl]piperazine
CID 171181941
1-[(1S)-1-[3-(difluoromethoxy)phenyl]-2-fluoroethyl]piperazine;dihydrochloride
CID 171290844
[3-[(1S)-1-piperazin-1-ylbutyl]phenyl] acetate;dihydrochloride
CID 171280252
(2S)-2-phenyl-2-piperazin-1-ylethanol;hydrochloride
CID 171183201
(2R)-2-naphthalen-2-yl-2-piperazin-1-ylethanol
CID 171183408
2-(1,4-diazepan-1-yl)-2-(3,5-dimethoxyphenyl)ethanol
CID 61050429
2-(azepan-1-yl)-2-(3-propan-2-yloxyphenyl)ethanamine
CID 61212628

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol?
The IUPAC name of 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol (CID 61210767) is 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol.
What is the SMILES notation for 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol?
The canonical SMILES for 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol is CC(C)Oc1cccc(C(CO)N2CCNCC2)c1.
What is the InChIKey of 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol?
The InChIKey is UHKLDZWFJLOUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(2)19-14-5-3-4-13(10-14)15(11-18)17-8-6-16-7-9-17/h3-5,10,12,15-16,18H,6-9,11H2,1-2H3.
What are the key properties of 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol?
2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol has a molecular weight of 264.37 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-2-(3-propan-2-yloxyphenyl)ethanol is sourced from PubChem (CID 61210767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).