2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol

C11H24N2O — CID 166175492

IUPAC2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol
SMILESCC(C)CN1CCN(CCO)C[C@H]1C
InChIInChI=1S/C11H24N2O/c1-10(2)8-13-5-4-12(6-7-14)9-11(13)3/h10-11,14H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyQPVOCSIHPPBUPU-LLVKDONJSA-N
MW200.33 g/mol
LogP0.64
Rot. Bonds4

About 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol

2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol (PubChem CID 166175492) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol
PubChem CID166175492
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol
SMILESCC(C)CN1CCN(CCO)C[C@H]1C
InChIInChI=1S/C11H24N2O/c1-10(2)8-13-5-4-12(6-7-14)9-11(13)3/h10-11,14H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyQPVOCSIHPPBUPU-LLVKDONJSA-N
XLogP0.64
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3S)-4-[(2S)-2-hydroxypropyl]-3-methylpiperazin-1-yl]butan-1-ol
CID 100842695
(2S)-2,4-dimethyl-1-(2-methylpropyl)piperazine
CID 171515421
(2S)-1-[(3R)-4-[(2R)-2-hydroxypropyl]-3-methylpiperazin-1-yl]propan-2-ol
CID 124776706
2-[(2S)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetic acid
CID 166175465
2-[(2S)-2-methyl-4-(3-piperidin-1-ylpropyl)piperazin-1-yl]ethanol
CID 99827529
2-[1-(2-methylpropyl)-4-pentylpiperazin-2-yl]ethanol
CID 56851949
2-[(2R)-2-methyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethanol
CID 166175485
(2S)-1-[(2R)-2-methyl-4-[2-[(1R,2R)-2-methylcyclohexyl]oxyethyl]piperazin-1-yl]propan-2-ol
CID 124840080
4-(2-hydroxyethyl)-2-methylpiperazine-1-carboxylic acid
CID 68651622
(2R)-4-(2-hydroxyethyl)-2-methylpiperazine-1-carbaldehyde
CID 153411070
(2S,6S)-1,2,6-trimethyl-4-(2-methylpropyl)piperazine
CID 171515774
(2R)-1-[(2S)-2-methyl-4-(2-methylprop-2-enyl)piperazin-1-yl]propan-2-ol
CID 95610920

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol (CID 166175492) is 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol is CC(C)CN1CCN(CCO)C[C@H]1C.
What is the InChIKey of 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol?
The InChIKey is QPVOCSIHPPBUPU-LLVKDONJSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(2)8-13-5-4-12(6-7-14)9-11(13)3/h10-11,14H,4-9H2,1-3H3/t11-/m1/s1.
What are the key properties of 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol?
2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol has a molecular weight of 200.33 g/mol, XLogP of 0.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-methyl-4-(2-methylpropyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 166175492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).