5,6,7,8-tetrahydroquinolin-3-ol

C9H11NO — CID 45079493

IUPAC5,6,7,8-tetrahydroquinolin-3-ol
SMILESOc1cnc2c(c1)CCCC2
InChIInChI=1S/C9H11NO/c11-8-5-7-3-1-2-4-9(7)10-6-8/h5-6,11H,1-4H2
InChIKeyPSXNUQKAJHVAPG-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.67
Rot. Bonds

About 5,6,7,8-tetrahydroquinolin-3-ol

5,6,7,8-tetrahydroquinolin-3-ol (PubChem CID 45079493) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 5,6,7,8-tetrahydroquinolin-3-ol.

Molecular Properties

Compound Name5,6,7,8-tetrahydroquinolin-3-ol
PubChem CID45079493
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name5,6,7,8-tetrahydroquinolin-3-ol
SMILESOc1cnc2c(c1)CCCC2
InChIInChI=1S/C9H11NO/c11-8-5-7-3-1-2-4-9(7)10-6-8/h5-6,11H,1-4H2
InChIKeyPSXNUQKAJHVAPG-UHFFFAOYSA-N
XLogP1.67
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydroquinolin-3-ol?
The IUPAC name of 5,6,7,8-tetrahydroquinolin-3-ol (CID 45079493) is 5,6,7,8-tetrahydroquinolin-3-ol.
What is the SMILES notation for 5,6,7,8-tetrahydroquinolin-3-ol?
The canonical SMILES for 5,6,7,8-tetrahydroquinolin-3-ol is Oc1cnc2c(c1)CCCC2.
What is the InChIKey of 5,6,7,8-tetrahydroquinolin-3-ol?
The InChIKey is PSXNUQKAJHVAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c11-8-5-7-3-1-2-4-9(7)10-6-8/h5-6,11H,1-4H2.
What are the key properties of 5,6,7,8-tetrahydroquinolin-3-ol?
5,6,7,8-tetrahydroquinolin-3-ol has a molecular weight of 149.19 g/mol, XLogP of 1.67, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydroquinolin-3-ol is sourced from PubChem (CID 45079493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).