[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol

C10H13NO — CID 10103467

IUPAC[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol
SMILESOC[C@@H]1CCc2ccccc2N1
InChIInChI=1S/C10H13NO/c12-7-9-6-5-8-3-1-2-4-10(8)11-9/h1-4,9,11-12H,5-7H2/t9-/m0/s1
InChIKeyQSDYZRIUFBMUGV-VIFPVBQESA-N
MW163.22 g/mol
LogP1.41
Rot. Bonds1

About [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol

[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol (PubChem CID 10103467) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol
PubChem CID10103467
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol
SMILESOC[C@@H]1CCc2ccccc2N1
InChIInChI=1S/C10H13NO/c12-7-9-6-5-8-3-1-2-4-10(8)11-9/h1-4,9,11-12H,5-7H2/t9-/m0/s1
InChIKeyQSDYZRIUFBMUGV-VIFPVBQESA-N
XLogP1.41
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol?
The IUPAC name of [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol (CID 10103467) is [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol.
What is the SMILES notation for [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol?
The canonical SMILES for [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol is OC[C@@H]1CCc2ccccc2N1.
What is the InChIKey of [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol?
The InChIKey is QSDYZRIUFBMUGV-VIFPVBQESA-N. The full InChI is InChI=1S/C10H13NO/c12-7-9-6-5-8-3-1-2-4-10(8)11-9/h1-4,9,11-12H,5-7H2/t9-/m0/s1.
What are the key properties of [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol?
[(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol has a molecular weight of 163.22 g/mol, XLogP of 1.41, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol is sourced from PubChem (CID 10103467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).