1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride

C15H32Cl2N2O2 — CID 18592923

IUPAC1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride
SMILESCCN1CCN(CC(O)COC2CCCC2C)CC1.Cl.Cl
InChIInChI=1S/C15H30N2O2.2ClH/c1-3-16-7-9-17(10-8-16)11-14(18)12-19-15-6-4-5-13(15)2;;/h13-15,18H,3-12H2,1-2H3;2*1H
InChIKeySSQQVRDTDICOAI-UHFFFAOYSA-N
MW343.34 g/mol
LogP2.03
Rot. Bonds6

About 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride

1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride (PubChem CID 18592923) has the molecular formula C15H32Cl2N2O2 and a molecular weight of 343.34 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride
PubChem CID18592923
Molecular FormulaC15H32Cl2N2O2
Molecular Weight343.34 g/mol
Exact Mass342.18
IUPAC Name1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride
SMILESCCN1CCN(CC(O)COC2CCCC2C)CC1.Cl.Cl
InChIInChI=1S/C15H30N2O2.2ClH/c1-3-16-7-9-17(10-8-16)11-14(18)12-19-15-6-4-5-13(15)2;;/h13-15,18H,3-12H2,1-2H3;2*1H
InChIKeySSQQVRDTDICOAI-UHFFFAOYSA-N
XLogP2.03
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 ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride 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-Methylcyclopentyloxy)-1-piperidylpropan-2-ol
CID 16456363
1-(Cyclopentyloxy)-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride
CID 16876984
1-((2-Methylcyclopentyl)oxy)-3-morpholinopropan-2-ol hydrochloride
CID 18592902
1-((2-Methylcyclopentyl)oxy)-3-(piperidin-1-yl)propan-2-ol hydrochloride
CID 18592904
1-(3,5-Dimethylpiperidin-1-YL)-3-[(2-methylcyclopentyl)oxy]propan-2-OL hydrochloride
CID 18592905
1-(2,6-Dimethylmorpholino)-3-((2-methylcyclopentyl)oxy)propan-2-ol hydrochloride
CID 18592906
1-((2-Methylcyclopentyl)oxy)-3-(4-methylpiperidin-1-yl)propan-2-ol hydrochloride
CID 18592907
1-[Bis(2-hydroxyethyl)amino]-3-[(2-methylcyclopentyl)oxy]propan-2-OL hydrochloride
CID 18592912
1-(4-(2-Hydroxyethyl)piperazin-1-yl)-3-((2-methylcyclopentyl)oxy)propan-2-ol dihydrochloride
CID 18592924
1-(Cyclopentyloxy)-3-(4-ethylpiperazin-1-yl)propan-2-ol dihydrochloride
CID 16876986
1-(2-Methylcyclopentyl)oxy-3-(4-methylpiperazin-1-yl)propan-2-ol;dihydrochloride
CID 18592922
1-(2,6-Dimethylmorpholin-4-yl)-3-(2-methylcyclopentyloxy)propan-2-ol
CID 16456360

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride (CID 18592923) is 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride is CCN1CCN(CC(O)COC2CCCC2C)CC1.Cl.Cl.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride?
The InChIKey is SSQQVRDTDICOAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.2ClH/c1-3-16-7-9-17(10-8-16)11-14(18)12-19-15-6-4-5-13(15)2;;/h13-15,18H,3-12H2,1-2H3;2*1H.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride?
1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride has a molecular weight of 343.34 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-3-(2-methylcyclopentyl)oxypropan-2-ol;dihydrochloride is sourced from PubChem (CID 18592923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).