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

C11H15NO — CID 82275587

IUPAC6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol
SMILESCCc1ccc2c(c1)C(O)CCN2
InChIInChI=1S/C11H15NO/c1-2-8-3-4-10-9(7-8)11(13)5-6-12-10/h3-4,7,11-13H,2,5-6H2,1H3
InChIKeyDRVKXPSUHOQGQY-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.10
Rot. Bonds1

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

6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol (PubChem CID 82275587) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol.

Molecular Properties

Compound Name6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol
PubChem CID82275587
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol
SMILESCCc1ccc2c(c1)C(O)CCN2
InChIInChI=1S/C11H15NO/c1-2-8-3-4-10-9(7-8)11(13)5-6-12-10/h3-4,7,11-13H,2,5-6H2,1H3
InChIKeyDRVKXPSUHOQGQY-UHFFFAOYSA-N
XLogP2.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol?
The IUPAC name of 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol (CID 82275587) is 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol.
What is the SMILES notation for 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol?
The canonical SMILES for 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol is CCc1ccc2c(c1)C(O)CCN2.
What is the InChIKey of 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol?
The InChIKey is DRVKXPSUHOQGQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-2-8-3-4-10-9(7-8)11(13)5-6-12-10/h3-4,7,11-13H,2,5-6H2,1H3.
What are the key properties of 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol?
6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol has a molecular weight of 177.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1,2,3,4-tetrahydroquinolin-4-ol is sourced from PubChem (CID 82275587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).