8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline

C15H22N2 — CID 114491149

IUPAC8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
SMILESCC1CCN(c2cccc3c2CNCC3)CC1
InChIInChI=1S/C15H22N2/c1-12-6-9-17(10-7-12)15-4-2-3-13-5-8-16-11-14(13)15/h2-4,12,16H,5-11H2,1H3
InChIKeyOPPDOWQLSKFXBH-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.57
Rot. Bonds1

About 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline

8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline (PubChem CID 114491149) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline.

Molecular Properties

Compound Name8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
PubChem CID114491149
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
SMILESCC1CCN(c2cccc3c2CNCC3)CC1
InChIInChI=1S/C15H22N2/c1-12-6-9-17(10-7-12)15-4-2-3-13-5-8-16-11-14(13)15/h2-4,12,16H,5-11H2,1H3
InChIKeyOPPDOWQLSKFXBH-UHFFFAOYSA-N
XLogP2.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline 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

8-(4-ethylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 103142180
5-(4-tert-butylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 81215388
tert-butyl 4-(1,2,3,4-tetrahydroisoquinolin-8-yl)piperazine-1-carboxylate
CID 21070954
4-methyl-1-(1,2,3,4-tetrahydroisoquinolin-5-yl)piperidin-2-one
CID 156565209
8-(3,5-dimethylcyclohexyl)-1,2,3,4-tetrahydroisoquinoline
CID 106779504
5-(2-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 81214550
8-(1,2,4-triazol-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 103144020
5-(3-piperidin-1-ylpyrrolidin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 81218421
8-(3-methylcyclopentyl)oxy-1,2,3,4-tetrahydroisoquinoline
CID 115076747
2-(4-methylpiperidin-1-yl)benzonitrile
CID 14931104
5-[(2,4-dimethylpiperidin-1-yl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 104557490
5-[4-(oxetan-3-yl)piperazin-1-yl]-1,2,3,4-tetrahydroisoquinoline
CID 146398294

Frequently Asked Questions

What is the IUPAC name of 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline?
The IUPAC name of 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline (CID 114491149) is 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline.
What is the SMILES notation for 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline?
The canonical SMILES for 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline is CC1CCN(c2cccc3c2CNCC3)CC1.
What is the InChIKey of 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline?
The InChIKey is OPPDOWQLSKFXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-12-6-9-17(10-7-12)15-4-2-3-13-5-8-16-11-14(13)15/h2-4,12,16H,5-11H2,1H3.
What are the key properties of 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline?
8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline has a molecular weight of 230.35 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methylpiperidin-1-yl)-1,2,3,4-tetrahydroisoquinoline is sourced from PubChem (CID 114491149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).