4-butylquinolin-6-ol

C13H15NO — CID 155350973

IUPAC4-butylquinolin-6-ol
SMILESCCCCc1ccnc2ccc(O)cc12
InChIInChI=1S/C13H15NO/c1-2-3-4-10-7-8-14-13-6-5-11(15)9-12(10)13/h5-9,15H,2-4H2,1H3
InChIKeyFDZGCPFIJFJWKT-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.28
Rot. Bonds3

About 4-butylquinolin-6-ol

4-butylquinolin-6-ol (PubChem CID 155350973) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-butylquinolin-6-ol.

Molecular Properties

Compound Name4-butylquinolin-6-ol
PubChem CID155350973
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name4-butylquinolin-6-ol
SMILESCCCCc1ccnc2ccc(O)cc12
InChIInChI=1S/C13H15NO/c1-2-3-4-10-7-8-14-13-6-5-11(15)9-12(10)13/h5-9,15H,2-4H2,1H3
InChIKeyFDZGCPFIJFJWKT-UHFFFAOYSA-N
XLogP3.28
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-butylquinolin-6-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-butylquinolin-6-ol?
The IUPAC name of 4-butylquinolin-6-ol (CID 155350973) is 4-butylquinolin-6-ol.
What is the SMILES notation for 4-butylquinolin-6-ol?
The canonical SMILES for 4-butylquinolin-6-ol is CCCCc1ccnc2ccc(O)cc12.
What is the InChIKey of 4-butylquinolin-6-ol?
The InChIKey is FDZGCPFIJFJWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-3-4-10-7-8-14-13-6-5-11(15)9-12(10)13/h5-9,15H,2-4H2,1H3.
What are the key properties of 4-butylquinolin-6-ol?
4-butylquinolin-6-ol has a molecular weight of 201.27 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butylquinolin-6-ol is sourced from PubChem (CID 155350973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).