2,3-dihydroisoquinolin-5-ol

C9H9NO — CID 91247829

IUPAC2,3-dihydroisoquinolin-5-ol
SMILESOc1cccc2c1=CCNC=2
InChIInChI=1S/C9H9NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h1-4,6,10-11H,5H2
InChIKeyMXRZYEWXDWKARH-UHFFFAOYSA-N
MW147.18 g/mol
LogP-0.49
Rot. Bonds

About 2,3-dihydroisoquinolin-5-ol

2,3-dihydroisoquinolin-5-ol (PubChem CID 91247829) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 2,3-dihydroisoquinolin-5-ol.

Molecular Properties

Compound Name2,3-dihydroisoquinolin-5-ol
PubChem CID91247829
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name2,3-dihydroisoquinolin-5-ol
SMILESOc1cccc2c1=CCNC=2
InChIInChI=1S/C9H9NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h1-4,6,10-11H,5H2
InChIKeyMXRZYEWXDWKARH-UHFFFAOYSA-N
XLogP-0.49
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 ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,3-dihydroisoquinolin-5-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2H-2-benzazepin-6-ol
CID 18004599
4a,5-Dihydrophenanthridin-10-ol
CID 57204550
5-methylidene-1H-quinolin-8-ol
CID 87400395
5-hydroxy-2H-isoquinolin-3-one
CID 103351525
2H-2-benzazepin-6-ol;hydrobromide
CID 141074641
1,8a-Dihydroquinolin-4-ol
CID 143552880
1-(4-Methyl-1,2-dihydropyridin-5-yl)ethenol
CID 145471802
2H-cyclohepta[c]pyridin-4-ol
CID 171853945
2-(1,2-Dihydropyridin-5-yl)propan-2-ol
CID 173120691
1-Amino-1-(1,2-dihydropyridin-4-yl)prop-2-en-1-ol
CID 174294309
6-Ethyl-2,3-dihydroisoquinolin-8-ol
CID 174963305
1,5-Dihydroquinolin-8-ol
CID 165154010

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroisoquinolin-5-ol?
The IUPAC name of 2,3-dihydroisoquinolin-5-ol (CID 91247829) is 2,3-dihydroisoquinolin-5-ol.
What is the SMILES notation for 2,3-dihydroisoquinolin-5-ol?
The canonical SMILES for 2,3-dihydroisoquinolin-5-ol is Oc1cccc2c1=CCNC=2.
What is the InChIKey of 2,3-dihydroisoquinolin-5-ol?
The InChIKey is MXRZYEWXDWKARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h1-4,6,10-11H,5H2.
What are the key properties of 2,3-dihydroisoquinolin-5-ol?
2,3-dihydroisoquinolin-5-ol has a molecular weight of 147.18 g/mol, XLogP of -0.49, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroisoquinolin-5-ol is sourced from PubChem (CID 91247829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).