6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol

C10H13NO2 — CID 23008907

IUPAC6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol
SMILESCOc1ccc2c(c1)C(O)CCN2
InChIInChI=1S/C10H13NO2/c1-13-7-2-3-9-8(6-7)10(12)4-5-11-9/h2-3,6,10-12H,4-5H2,1H3
InChIKeyHDKOHPPRCQYVJA-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.54
Rot. Bonds1

About 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol

6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol (PubChem CID 23008907) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol.

Molecular Properties

Compound Name6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol
PubChem CID23008907
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol
SMILESCOc1ccc2c(c1)C(O)CCN2
InChIInChI=1S/C10H13NO2/c1-13-7-2-3-9-8(6-7)10(12)4-5-11-9/h2-3,6,10-12H,4-5H2,1H3
InChIKeyHDKOHPPRCQYVJA-UHFFFAOYSA-N
XLogP1.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Ethoxyquin
CID 3293
6-Ethoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline
CID 86013
3-(4-Ethoxyanilino)-1-(4-fluorophenyl)-1-propanol
CID 3427706
Quinoline, 1,2,3,4-tetrahydro-6-methoxy-
CID 67113
2-(((4-Methoxyphenyl)amino)methyl)phenol
CID 269972
6-Methoxyquinoline-2,4-diol
CID 54677702
6-(3-(Piperidin-1-yl)propoxy)-1,2,3,4-tetrahydroquinoline
CID 9974962
1-(4-Methoxy-2-methylphenyl)piperazine
CID 10750797
6-ethoxyspiro[1H-quinoline-2,4'-piperidine]
CID 44383698
8-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 68803474
(4aS,5R,10bS)-9-(3-methylbutoxy)-5-piperidin-4-yl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
CID 71654693
(4aS,5R,10bS)-5-(1-ethylpiperidin-4-yl)-9-(3-methylbutoxy)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
CID 71654694

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol?
The IUPAC name of 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol (CID 23008907) is 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol.
What is the SMILES notation for 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol?
The canonical SMILES for 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol is COc1ccc2c(c1)C(O)CCN2.
What is the InChIKey of 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol?
The InChIKey is HDKOHPPRCQYVJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-13-7-2-3-9-8(6-7)10(12)4-5-11-9/h2-3,6,10-12H,4-5H2,1H3.
What are the key properties of 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol?
6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol has a molecular weight of 179.22 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,2,3,4-tetrahydroquinolin-4-ol is sourced from PubChem (CID 23008907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).