2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol

C15H24N2O — CID 117374519

IUPAC2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol
SMILESCC(C)N1CCN(c2ccccc2CCO)CC1
InChIInChI=1S/C15H24N2O/c1-13(2)16-8-10-17(11-9-16)15-6-4-3-5-14(15)7-12-18/h3-6,13,18H,7-12H2,1-2H3
InChIKeyHJLXGUAZJHVFTH-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.75
Rot. Bonds4

About 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol

2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol (PubChem CID 117374519) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol
PubChem CID117374519
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol
SMILESCC(C)N1CCN(c2ccccc2CCO)CC1
InChIInChI=1S/C15H24N2O/c1-13(2)16-8-10-17(11-9-16)15-6-4-3-5-14(15)7-12-18/h3-6,13,18H,7-12H2,1-2H3
InChIKeyHJLXGUAZJHVFTH-UHFFFAOYSA-N
XLogP1.75
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 ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]methanamine
CID 43585498
N-[[2-(4-propan-2-ylpiperazin-1-yl)phenyl]methyl]propan-1-amine
CID 43585499
2-[4-[2-(2-hydroxyethyl)phenyl]piperazin-1-yl]acetic acid
CID 57285228
2-[2-[4-(3-chlorophenyl)piperazin-1-yl]phenyl]ethanol
CID 67827124
2-[[2-(aziridin-1-yl)phenyl]methyl]butane-1,3-diol
CID 88844740
2-[4-[3-(4-propan-2-ylpiperazin-1-yl)propyl]piperazin-1-yl]phenol
CID 122157490
[4-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]methanol
CID 81238726
1-methyl-4-(2-propylphenyl)piperazine
CID 21034052
2-hydroxy-2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]acetic acid
CID 117446340
4-[2-(aziridin-1-yl)phenyl]-3-methylbutane-1,3-diol
CID 88844741
3-[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]propan-1-ol
CID 170887594
3-[2-(4-methylpiperazin-1-yl)phenyl]propanoic acid
CID 28807045

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol?
The IUPAC name of 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol (CID 117374519) is 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol.
What is the SMILES notation for 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol?
The canonical SMILES for 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol is CC(C)N1CCN(c2ccccc2CCO)CC1.
What is the InChIKey of 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol?
The InChIKey is HJLXGUAZJHVFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-13(2)16-8-10-17(11-9-16)15-6-4-3-5-14(15)7-12-18/h3-6,13,18H,7-12H2,1-2H3.
What are the key properties of 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol?
2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol has a molecular weight of 248.37 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-propan-2-ylpiperazin-1-yl)phenyl]ethanol is sourced from PubChem (CID 117374519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).