2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride

C11H21Cl2N3O — CID 71298828

IUPAC2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride
SMILESCl.Cl.Cn1nc(C2CCCNC2)cc1CCO
InChIInChI=1S/C11H19N3O.2ClH/c1-14-10(4-6-15)7-11(13-14)9-3-2-5-12-8-9;;/h7,9,12,15H,2-6,8H2,1H3;2*1H
InChIKeyHGAUANXBWMFESN-UHFFFAOYSA-N
MW282.21 g/mol
LogP1.27
Rot. Bonds3

About 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride

2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride (PubChem CID 71298828) has the molecular formula C11H21Cl2N3O and a molecular weight of 282.21 g/mol. Its IUPAC name is 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride.

Molecular Properties

Compound Name2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride
PubChem CID71298828
Molecular FormulaC11H21Cl2N3O
Molecular Weight282.21 g/mol
Exact Mass281.11
IUPAC Name2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride
SMILESCl.Cl.Cn1nc(C2CCCNC2)cc1CCO
InChIInChI=1S/C11H19N3O.2ClH/c1-14-10(4-6-15)7-11(13-14)9-3-2-5-12-8-9;;/h7,9,12,15H,2-6,8H2,1H3;2*1H
InChIKeyHGAUANXBWMFESN-UHFFFAOYSA-N
XLogP1.27
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.21
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;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

1-[(1-methyl-3-piperidin-3-ylpyrazol-5-yl)methyl]piperidine
CID 172524135
N,2-dimethyl-N-[[1-methyl-3-[(3S)-piperidin-3-yl]pyrazol-5-yl]methyl]propanamide
CID 92623880
3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
CID 83833173
2-cyclohexyl-N-methyl-N-[[1-methyl-3-[(3S)-piperidin-3-yl]pyrazol-5-yl]methyl]acetamide
CID 92623846
[4-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]piperidin-1-yl]-[(3R)-piperidin-3-yl]methanone
CID 92624522
[4-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]piperidin-1-yl]-piperidin-3-ylmethanone
CID 110259661
(3R)-3-(2H-triazol-4-yl)piperidine;hydrochloride
CID 170900819
3-(2-ethyltriazol-4-yl)piperidine
CID 10012528
1-(2,5-dimethylpyrazol-3-yl)-3-piperidin-3-ylpropan-2-one
CID 116564213
N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-[(3S)-piperidin-3-yl]benzamide
CID 99939569
4-ethyl-2-(4-hydroxybutyl)-5-piperidin-3-yl-1,2,4-triazol-3-one;dihydrochloride
CID 171687125
3-(4-ethyl-1,2,4-triazol-3-yl)piperidine;dihydrochloride
CID 50988337

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride?
The IUPAC name of 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride (CID 71298828) is 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride.
What is the SMILES notation for 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride?
The canonical SMILES for 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride is Cl.Cl.Cn1nc(C2CCCNC2)cc1CCO.
What is the InChIKey of 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride?
The InChIKey is HGAUANXBWMFESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O.2ClH/c1-14-10(4-6-15)7-11(13-14)9-3-2-5-12-8-9;;/h7,9,12,15H,2-6,8H2,1H3;2*1H.
What are the key properties of 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride?
2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride has a molecular weight of 282.21 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-3-piperidin-3-ylpyrazol-5-yl)ethanol;dihydrochloride is sourced from PubChem (CID 71298828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).