2-cyclobutyl-5-methoxyquinolin-3-ol

C14H15NO2 — CID 165487727

IUPAC2-cyclobutyl-5-methoxyquinolin-3-ol
SMILESCOc1cccc2nc(C3CCC3)c(O)cc12
InChIInChI=1S/C14H15NO2/c1-17-13-7-3-6-11-10(13)8-12(16)14(15-11)9-4-2-5-9/h3,6-9,16H,2,4-5H2,1H3
InChIKeyHBBNDDQYKVUUFU-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.22
Rot. Bonds2

About 2-cyclobutyl-5-methoxyquinolin-3-ol

2-cyclobutyl-5-methoxyquinolin-3-ol (PubChem CID 165487727) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-cyclobutyl-5-methoxyquinolin-3-ol.

Molecular Properties

Compound Name2-cyclobutyl-5-methoxyquinolin-3-ol
PubChem CID165487727
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name2-cyclobutyl-5-methoxyquinolin-3-ol
SMILESCOc1cccc2nc(C3CCC3)c(O)cc12
InChIInChI=1S/C14H15NO2/c1-17-13-7-3-6-11-10(13)8-12(16)14(15-11)9-4-2-5-9/h3,6-9,16H,2,4-5H2,1H3
InChIKeyHBBNDDQYKVUUFU-UHFFFAOYSA-N
XLogP3.22
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-5-methoxyquinolin-3-ol?
The IUPAC name of 2-cyclobutyl-5-methoxyquinolin-3-ol (CID 165487727) is 2-cyclobutyl-5-methoxyquinolin-3-ol.
What is the SMILES notation for 2-cyclobutyl-5-methoxyquinolin-3-ol?
The canonical SMILES for 2-cyclobutyl-5-methoxyquinolin-3-ol is COc1cccc2nc(C3CCC3)c(O)cc12.
What is the InChIKey of 2-cyclobutyl-5-methoxyquinolin-3-ol?
The InChIKey is HBBNDDQYKVUUFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-17-13-7-3-6-11-10(13)8-12(16)14(15-11)9-4-2-5-9/h3,6-9,16H,2,4-5H2,1H3.
What are the key properties of 2-cyclobutyl-5-methoxyquinolin-3-ol?
2-cyclobutyl-5-methoxyquinolin-3-ol has a molecular weight of 229.28 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-5-methoxyquinolin-3-ol is sourced from PubChem (CID 165487727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).