5-hexoxy-2-methylquinolin-8-ol

C16H21NO2 — CID 101001926

IUPAC5-hexoxy-2-methylquinolin-8-ol
SMILESCCCCCCOc1ccc(O)c2nc(C)ccc12
InChIInChI=1S/C16H21NO2/c1-3-4-5-6-11-19-15-10-9-14(18)16-13(15)8-7-12(2)17-16/h7-10,18H,3-6,11H2,1-2H3
InChIKeyJNEWCWCEFJVYEC-UHFFFAOYSA-N
MW259.35 g/mol
LogP4.21
Rot. Bonds6

About 5-hexoxy-2-methylquinolin-8-ol

5-hexoxy-2-methylquinolin-8-ol (PubChem CID 101001926) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-hexoxy-2-methylquinolin-8-ol.

Molecular Properties

Compound Name5-hexoxy-2-methylquinolin-8-ol
PubChem CID101001926
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name5-hexoxy-2-methylquinolin-8-ol
SMILESCCCCCCOc1ccc(O)c2nc(C)ccc12
InChIInChI=1S/C16H21NO2/c1-3-4-5-6-11-19-15-10-9-14(18)16-13(15)8-7-12(2)17-16/h7-10,18H,3-6,11H2,1-2H3
InChIKeyJNEWCWCEFJVYEC-UHFFFAOYSA-N
XLogP4.21
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-hexoxy-2-methylquinolin-8-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

5-(hexoxymethyl)-2-methylquinolin-8-ol
CID 15817747
2,3,4-tridodecoxyphenol
CID 67180426
3-heptoxy-6-methylpyridine-2-carboxylic acid
CID 79156653
3-hexoxy-6-methylpyridine-2-carboxylic acid
CID 79156664
1,4,5,8-tetrahexoxyanthracene
CID 101142141
4-methyl-2-tetradecoxyphenol
CID 19014152
1,4-didodecoxynaphthalene
CID 21304164
8-[2-[2-[2-(2-carboxy-5-dodecoxyquinolin-8-yl)oxyethoxy]ethoxy]ethoxy]-5-dodecoxyquinoline-2-carboxylic acid
CID 54378179
2,3-dipentoxyphenol
CID 57426098
2-(6-methyl-3-pentoxy-2-pyridinyl)ethanamine
CID 79168982
2-tridecoxyphenol
CID 67178320
8,9,10-tridodecoxy-3-methylbenzo[f]quinoline-5-carbaldehyde
CID 10887231

Frequently Asked Questions

What is the IUPAC name of 5-hexoxy-2-methylquinolin-8-ol?
The IUPAC name of 5-hexoxy-2-methylquinolin-8-ol (CID 101001926) is 5-hexoxy-2-methylquinolin-8-ol.
What is the SMILES notation for 5-hexoxy-2-methylquinolin-8-ol?
The canonical SMILES for 5-hexoxy-2-methylquinolin-8-ol is CCCCCCOc1ccc(O)c2nc(C)ccc12.
What is the InChIKey of 5-hexoxy-2-methylquinolin-8-ol?
The InChIKey is JNEWCWCEFJVYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-3-4-5-6-11-19-15-10-9-14(18)16-13(15)8-7-12(2)17-16/h7-10,18H,3-6,11H2,1-2H3.
What are the key properties of 5-hexoxy-2-methylquinolin-8-ol?
5-hexoxy-2-methylquinolin-8-ol has a molecular weight of 259.35 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hexoxy-2-methylquinolin-8-ol is sourced from PubChem (CID 101001926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).