(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol

C13H26N2O2 — CID 1132916

IUPAC(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol
SMILESO[C@@H](COC1CCCCC1)CN1CCNCC1
InChIInChI=1S/C13H26N2O2/c16-12(10-15-8-6-14-7-9-15)11-17-13-4-2-1-3-5-13/h12-14,16H,1-11H2/t12-/m1/s1
InChIKeyFXQLZFXUIURPMU-GFCCVEGCSA-N
MW242.36 g/mol
LogP0.60
Rot. Bonds5

About (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol

(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol (PubChem CID 1132916) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol
PubChem CID1132916
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol
SMILESO[C@@H](COC1CCCCC1)CN1CCNCC1
InChIInChI=1S/C13H26N2O2/c16-12(10-15-8-6-14-7-9-15)11-17-13-4-2-1-3-5-13/h12-14,16H,1-11H2/t12-/m1/s1
InChIKeyFXQLZFXUIURPMU-GFCCVEGCSA-N
XLogP0.60
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-cyclohexyloxy-3-[4-[(2R)-3-cyclohexyloxy-2-hydroxypropyl]piperazin-1-yl]propan-2-ol
CID 1120303
1-cyclohexyloxy-3-(4-methylpiperidin-1-yl)propan-2-ol;hydrochloride
CID 44782571
(2S)-1-cyclopentyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol
CID 30726287
1-cyclopentyloxy-3-morpholin-4-ylpropan-2-ol;hydrochloride
CID 16958185
1-(3-ethoxypiperidin-1-yl)-3-piperazin-1-ylpropan-2-ol
CID 65448874
1-cyclohexyloxy-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol;dihydrochloride
CID 44782587
(2S)-1-cyclopentyloxy-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol
CID 42588067
(2S)-1-cyclohexyloxy-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol
CID 696962
[4-(3-cyclohexyloxy-2-hydroxypropyl)piperazin-1-yl]-phenylmethanone
CID 2930774
1-cyclopentyloxy-3-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
CID 62991174
1-cyclohexyloxy-3-(2-piperidin-1-ylethylamino)propan-2-ol
CID 60969149
1,3-bis[4-(cyclopentylmethoxy)piperidin-1-yl]propan-2-ol
CID 166234408

Frequently Asked Questions

What is the IUPAC name of (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol?
The IUPAC name of (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol (CID 1132916) is (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol.
What is the SMILES notation for (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol?
The canonical SMILES for (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol is O[C@@H](COC1CCCCC1)CN1CCNCC1.
What is the InChIKey of (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol?
The InChIKey is FXQLZFXUIURPMU-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H26N2O2/c16-12(10-15-8-6-14-7-9-15)11-17-13-4-2-1-3-5-13/h12-14,16H,1-11H2/t12-/m1/s1.
What are the key properties of (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol?
(2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol has a molecular weight of 242.36 g/mol, XLogP of 0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-cyclohexyloxy-3-piperazin-1-ylpropan-2-ol is sourced from PubChem (CID 1132916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).