6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol

C14H20N2O — CID 141205885

IUPAC6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol
SMILESOC1CNCc2ccc(N3CCCCC3)cc21
InChIInChI=1S/C14H20N2O/c17-14-10-15-9-11-4-5-12(8-13(11)14)16-6-2-1-3-7-16/h4-5,8,14-15,17H,1-3,6-7,9-10H2
InChIKeyRTFXFBJGEGDRIH-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.81
Rot. Bonds1

About 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol

6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol (PubChem CID 141205885) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol.

Molecular Properties

Compound Name6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol
PubChem CID141205885
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol
SMILESOC1CNCc2ccc(N3CCCCC3)cc21
InChIInChI=1S/C14H20N2O/c17-14-10-15-9-11-4-5-12(8-13(11)14)16-6-2-1-3-7-16/h4-5,8,14-15,17H,1-3,6-7,9-10H2
InChIKeyRTFXFBJGEGDRIH-UHFFFAOYSA-N
XLogP1.81
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Analyze 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol 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

6-piperidin-1-yl-1,2,3,4-tetrahydroquinolin-3-ol
CID 107447221
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
(9S)-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinolin-9-ol
CID 977765
(4R)-6-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 9170420
6-(azocan-1-yl)-3-hydroxy-1,3-dihydroindol-2-one
CID 43586661
1-(13-piperidin-1-yl-5-tricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaenyl)piperidine
CID 71530997
1-(4-piperidin-1-ylphenyl)piperidin-4-ol
CID 82090298
2,4-di(piperidin-1-yl)phenol
CID 130450866
6-(4-fluoropiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 175999345
7-methoxy-1,2,3,4-tetrahydroisoquinolin-4-ol;hydrochloride
CID 161060246
7-chloro-2,3,4,5-tetrahydro-1H-2-benzazepin-5-ol
CID 83679545
4-(azocan-1-yl)benzene-1,2-diamine
CID 106750210

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol?
The IUPAC name of 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol (CID 141205885) is 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol.
What is the SMILES notation for 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol?
The canonical SMILES for 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol is OC1CNCc2ccc(N3CCCCC3)cc21.
What is the InChIKey of 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol?
The InChIKey is RTFXFBJGEGDRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c17-14-10-15-9-11-4-5-12(8-13(11)14)16-6-2-1-3-7-16/h4-5,8,14-15,17H,1-3,6-7,9-10H2.
What are the key properties of 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol?
6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol has a molecular weight of 232.33 g/mol, XLogP of 1.81, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-1-yl-1,2,3,4-tetrahydroisoquinolin-4-ol is sourced from PubChem (CID 141205885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).