2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol

C14H22N2O — CID 65461803

IUPAC2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol
SMILESCC1(C)CNCCN1CC(O)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(2)11-15-8-9-16(14)10-13(17)12-6-4-3-5-7-12/h3-7,13,15,17H,8-11H2,1-2H3
InChIKeyXKKCCSDWPBUNHS-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.40
Rot. Bonds3

About 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol

2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol (PubChem CID 65461803) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol.

Molecular Properties

Compound Name2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol
PubChem CID65461803
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol
SMILESCC1(C)CNCCN1CC(O)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(2)11-15-8-9-16(14)10-13(17)12-6-4-3-5-7-12/h3-7,13,15,17H,8-11H2,1-2H3
InChIKeyXKKCCSDWPBUNHS-UHFFFAOYSA-N
XLogP1.40
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,2-dimethylpiperazin-1-yl)propane-1,2-diol
CID 82850350
1-(2,2-dimethylpiperazin-1-yl)-3-methoxypropan-2-ol
CID 65460991
2,2-dimethyl-1-[(4-phenylphenyl)methyl]piperazine
CID 65462302
2-(2,2-dimethylpiperazin-1-yl)-N-methyl-N-phenylacetamide
CID 65460575
1-cyclopentyl-3-(2,2-dimethylpiperazin-1-yl)propan-2-ol
CID 103160869
2-[(2S)-2-methylpiperazin-1-yl]-1-phenylethanol
CID 82755402
1-(2-ethylbutyl)-2,2-dimethylpiperazine
CID 65463532
2,2-dimethyl-1-(2-methyl-1-phenylpropyl)piperazine
CID 65461902
2,2-dimethyl-1-(2-methylbutyl)piperazine
CID 63594730
2-(2,2-dimethylpiperazin-1-yl)-N-(2-methylsulfanylphenyl)acetamide
CID 65460794
(1S)-1-(4-bromophenyl)-2-(3,3-dimethylmorpholin-4-yl)ethanol
CID 92858364
2,2-dimethyl-1-[(4-methylphenyl)methyl]piperazine
CID 63596118

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol?
The IUPAC name of 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol (CID 65461803) is 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol.
What is the SMILES notation for 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol?
The canonical SMILES for 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol is CC1(C)CNCCN1CC(O)c1ccccc1.
What is the InChIKey of 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol?
The InChIKey is XKKCCSDWPBUNHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-14(2)11-15-8-9-16(14)10-13(17)12-6-4-3-5-7-12/h3-7,13,15,17H,8-11H2,1-2H3.
What are the key properties of 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol?
2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol has a molecular weight of 234.34 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpiperazin-1-yl)-1-phenylethanol is sourced from PubChem (CID 65461803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).