1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride

C15H32Cl2N2O2 — CID 44782589

IUPAC1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride
SMILESCCN1CCN(CC(O)COC2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C15H30N2O2.2ClH/c1-2-16-8-10-17(11-9-16)12-14(18)13-19-15-6-4-3-5-7-15;;/h14-15,18H,2-13H2,1H3;2*1H
InChIKeyJFEBLJIWEGIDBY-UHFFFAOYSA-N
MW343.34 g/mol
LogP2.18
Rot. Bonds6

About 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride

1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride (PubChem CID 44782589) has the molecular formula C15H32Cl2N2O2 and a molecular weight of 343.34 g/mol. Its IUPAC name is 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride.

Molecular Properties

Compound Name1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride
PubChem CID44782589
Molecular FormulaC15H32Cl2N2O2
Molecular Weight343.34 g/mol
Exact Mass342.18
IUPAC Name1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride
SMILESCCN1CCN(CC(O)COC2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C15H30N2O2.2ClH/c1-2-16-8-10-17(11-9-16)12-14(18)13-19-15-6-4-3-5-7-15;;/h14-15,18H,2-13H2,1H3;2*1H
InChIKeyJFEBLJIWEGIDBY-UHFFFAOYSA-N
XLogP2.18
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.34
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Cyclohexyloxy)-3-(2,6-dimethyl-4-morpholinyl)-2-propanol hydrochloride
CID 18592780
1-(Cyclopentyloxy)-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride
CID 16876984
1-(Cyclopentyloxy)-3-[4-(2-hydroxyethyl)piperazin-1-YL]propan-2-OL dihydrochloride
CID 16876988
1-(Cyclohexyloxy)-3-(2,6-dimethylmorpholino)propan-2-ol hydrochloride
CID 18592779
1-[4-[(2S)-3-cyclohexyloxy-2-hydroxypropyl]piperazin-1-yl]ethanone
CID 6541610
3-Cyclohexyloxy-1-[4-(3-cyclohexyloxy-2-hydroxypropyl)piperazinyl]propan-2-ol
CID 3130416
1-[4-(3-Cyclohexyloxy-2-hydroxypropyl)piperazin-1-yl]ethanone
CID 3151631
1-(Cyclopentyloxy)-3-(4-ethylpiperazin-1-yl)propan-2-ol dihydrochloride
CID 16876986
1-Butoxy-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride
CID 16958253
1-Butoxy-3-(4-(2-hydroxyethyl)piperazin-1-yl)propan-2-ol dihydrochloride
CID 16958263
1-Cyclohexyloxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-2-ol;dihydrochloride
CID 18592783
1-Cyclohexyloxy-3-morpholin-4-ylpropan-2-ol;hydrochloride
CID 44782533

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride?
The IUPAC name of 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride (CID 44782589) is 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride.
What is the SMILES notation for 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride?
The canonical SMILES for 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride is CCN1CCN(CC(O)COC2CCCCC2)CC1.Cl.Cl.
What is the InChIKey of 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride?
The InChIKey is JFEBLJIWEGIDBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.2ClH/c1-2-16-8-10-17(11-9-16)12-14(18)13-19-15-6-4-3-5-7-15;;/h14-15,18H,2-13H2,1H3;2*1H.
What are the key properties of 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride?
1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride has a molecular weight of 343.34 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyloxy-3-(4-ethylpiperazin-1-yl)propan-2-ol;dihydrochloride is sourced from PubChem (CID 44782589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).