2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol

C15H24N2O — CID 117028316

IUPAC2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol
SMILESCC(C)c1ccccc1N1CCN(CCO)CC1
InChIInChI=1S/C15H24N2O/c1-13(2)14-5-3-4-6-15(14)17-9-7-16(8-10-17)11-12-18/h3-6,13,18H,7-12H2,1-2H3
InChIKeyAJFZLPSYKBGELX-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.92
Rot. Bonds4

About 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol

2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol (PubChem CID 117028316) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol
PubChem CID117028316
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol
SMILESCC(C)c1ccccc1N1CCN(CCO)CC1
InChIInChI=1S/C15H24N2O/c1-13(2)14-5-3-4-6-15(14)17-9-7-16(8-10-17)11-12-18/h3-6,13,18H,7-12H2,1-2H3
InChIKeyAJFZLPSYKBGELX-UHFFFAOYSA-N
XLogP1.92
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-[(1S)-1-aminoethyl]phenyl]piperazin-1-yl]ethanol
CID 55189416
1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]ethanol
CID 43592199
3-[4-(2-propan-2-ylphenyl)piperazin-1-yl]propanenitrile
CID 117028309
1-[2-(4-propylpiperazin-1-yl)phenyl]ethanol
CID 43510167
2-[1-(2-propan-2-ylphenyl)piperidin-4-yl]ethanol
CID 117003516
1-(2-propan-2-ylphenyl)pyrrolidine
CID 10607693
2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
CID 71671571
2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoic acid
CID 25360108
2-[4-[2-(1-aminoethyl)-4-fluorophenyl]piperazin-1-yl]ethanol
CID 43592142
2-[4-(2-ethylsulfonylphenyl)piperazin-1-yl]ethanol
CID 61150559
1-(2-propan-2-ylphenyl)piperazine
CID 3608822
2-[1-(2-propan-2-ylphenyl)pyrrolidin-3-yl]ethanol
CID 117028454

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol (CID 117028316) is 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol is CC(C)c1ccccc1N1CCN(CCO)CC1.
What is the InChIKey of 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol?
The InChIKey is AJFZLPSYKBGELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-13(2)14-5-3-4-6-15(14)17-9-7-16(8-10-17)11-12-18/h3-6,13,18H,7-12H2,1-2H3.
What are the key properties of 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol?
2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol has a molecular weight of 248.37 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-propan-2-ylphenyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 117028316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).