1,2,5,6-tetrahydroquinolin-8-ol

C9H11NO — CID 170048801

IUPAC1,2,5,6-tetrahydroquinolin-8-ol
SMILESOC1=CCCC2=C1NCC=C2
InChIInChI=1S/C9H11NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h2,4-5,10-11H,1,3,6H2
InChIKeyMTLLTDCGZBXXOD-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.64
Rot. Bonds

About 1,2,5,6-tetrahydroquinolin-8-ol

1,2,5,6-tetrahydroquinolin-8-ol (PubChem CID 170048801) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 1,2,5,6-tetrahydroquinolin-8-ol.

Molecular Properties

Compound Name1,2,5,6-tetrahydroquinolin-8-ol
PubChem CID170048801
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name1,2,5,6-tetrahydroquinolin-8-ol
SMILESOC1=CCCC2=C1NCC=C2
InChIInChI=1S/C9H11NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h2,4-5,10-11H,1,3,6H2
InChIKeyMTLLTDCGZBXXOD-UHFFFAOYSA-N
XLogP1.64
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,5,6-tetrahydroquinolin-8-ol?
The IUPAC name of 1,2,5,6-tetrahydroquinolin-8-ol (CID 170048801) is 1,2,5,6-tetrahydroquinolin-8-ol.
What is the SMILES notation for 1,2,5,6-tetrahydroquinolin-8-ol?
The canonical SMILES for 1,2,5,6-tetrahydroquinolin-8-ol is OC1=CCCC2=C1NCC=C2.
What is the InChIKey of 1,2,5,6-tetrahydroquinolin-8-ol?
The InChIKey is MTLLTDCGZBXXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h2,4-5,10-11H,1,3,6H2.
What are the key properties of 1,2,5,6-tetrahydroquinolin-8-ol?
1,2,5,6-tetrahydroquinolin-8-ol has a molecular weight of 149.19 g/mol, XLogP of 1.64, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5,6-tetrahydroquinolin-8-ol is sourced from PubChem (CID 170048801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).