1,8a-dihydroquinolin-4-ol

C9H9NO — CID 143552880

IUPAC1,8a-dihydroquinolin-4-ol
SMILESOC1=C2C=CC=CC2NC=C1
InChIInChI=1S/C9H9NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6,8,10-11H
InChIKeyAPTYZHBIQKLKCC-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.41
Rot. Bonds

About 1,8a-dihydroquinolin-4-ol

1,8a-dihydroquinolin-4-ol (PubChem CID 143552880) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 1,8a-dihydroquinolin-4-ol.

Molecular Properties

Compound Name1,8a-dihydroquinolin-4-ol
PubChem CID143552880
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name1,8a-dihydroquinolin-4-ol
SMILESOC1=C2C=CC=CC2NC=C1
InChIInChI=1S/C9H9NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6,8,10-11H
InChIKeyAPTYZHBIQKLKCC-UHFFFAOYSA-N
XLogP1.41
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,8a-dihydroquinolin-4-ol?
The IUPAC name of 1,8a-dihydroquinolin-4-ol (CID 143552880) is 1,8a-dihydroquinolin-4-ol.
What is the SMILES notation for 1,8a-dihydroquinolin-4-ol?
The canonical SMILES for 1,8a-dihydroquinolin-4-ol is OC1=C2C=CC=CC2NC=C1.
What is the InChIKey of 1,8a-dihydroquinolin-4-ol?
The InChIKey is APTYZHBIQKLKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6,8,10-11H.
What are the key properties of 1,8a-dihydroquinolin-4-ol?
1,8a-dihydroquinolin-4-ol has a molecular weight of 147.18 g/mol, XLogP of 1.41, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8a-dihydroquinolin-4-ol is sourced from PubChem (CID 143552880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).