2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol

C12H17NO2 — CID 105460503

IUPAC2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol
SMILESCOc1ccc2c(c1)CCC(CCO)N2
InChIInChI=1S/C12H17NO2/c1-15-11-4-5-12-9(8-11)2-3-10(13-12)6-7-14/h4-5,8,10,13-14H,2-3,6-7H2,1H3
InChIKeyBFIAKGMSJMQQCF-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.80
Rot. Bonds3

About 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol

2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol (PubChem CID 105460503) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol
PubChem CID105460503
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol
SMILESCOc1ccc2c(c1)CCC(CCO)N2
InChIInChI=1S/C12H17NO2/c1-15-11-4-5-12-9(8-11)2-3-10(13-12)6-7-14/h4-5,8,10,13-14H,2-3,6-7H2,1H3
InChIKeyBFIAKGMSJMQQCF-UHFFFAOYSA-N
XLogP1.80
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol 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

(2S)-2-ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
CID 131025344
[(2R)-7-methoxy-1,2,3,4-tetrahydroquinolin-2-yl]methanol
CID 130625960
6-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 12715494
7-methoxy-2-methyl-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 12827785
2-(5-methoxy-2,3-dihydro-1H-indol-2-yl)acetaldehyde
CID 112710978
1-(5-methoxy-2,3-dihydro-1H-indol-2-yl)-N,N-dimethylmethanamine
CID 84739877
6-methoxy-1,2,3,4-tetrahydroquinoline-2-carboxylic acid;hydrochloride
CID 70503014
6-methoxy-1,2,3,4-tetrahydroquinoline-2-carbaldehyde
CID 140970249
2-(6-bromo-1,2,3,4-tetrahydroquinolin-2-yl)-N-methylethanamine
CID 84641162
2-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 15720552
5-methoxy-N,N-dimethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 70908053
[(2R)-6-methylsulfanyl-1,2,3,4-tetrahydroquinolin-2-yl]methanol
CID 130626606

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The IUPAC name of 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol (CID 105460503) is 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol.
What is the SMILES notation for 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The canonical SMILES for 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol is COc1ccc2c(c1)CCC(CCO)N2.
What is the InChIKey of 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The InChIKey is BFIAKGMSJMQQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-15-11-4-5-12-9(8-11)2-3-10(13-12)6-7-14/h4-5,8,10,13-14H,2-3,6-7H2,1H3.
What are the key properties of 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol has a molecular weight of 207.27 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)ethanol is sourced from PubChem (CID 105460503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).