1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol

C16H21NO2 — CID 59393145

IUPAC1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol
SMILESCCCC(O)c1ccc2cc(CC)c(OC)nc2c1
InChIInChI=1S/C16H21NO2/c1-4-6-15(18)13-8-7-12-9-11(5-2)16(19-3)17-14(12)10-13/h7-10,15,18H,4-6H2,1-3H3
InChIKeyBIUPARRLGGOAGA-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.64
Rot. Bonds5

About 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol

1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol (PubChem CID 59393145) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol.

Molecular Properties

Compound Name1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol
PubChem CID59393145
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol
SMILESCCCC(O)c1ccc2cc(CC)c(OC)nc2c1
InChIInChI=1S/C16H21NO2/c1-4-6-15(18)13-8-7-12-9-11(5-2)16(19-3)17-14(12)10-13/h7-10,15,18H,4-6H2,1-3H3
InChIKeyBIUPARRLGGOAGA-UHFFFAOYSA-N
XLogP3.64
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-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

(3-ethyl-2-methoxyquinolin-7-yl)boronic acid
CID 59474872
cyclopropyl-(3-ethyl-2-methoxyquinolin-7-yl)methanone
CID 59393071
(1S)-1-(4-methoxy-3-methylphenyl)butan-1-ol
CID 39239112
(1R)-1-(3-bromo-4-methoxyphenyl)butan-1-ol
CID 93189097
1-(3-methoxyphenyl)butan-1-ol
CID 2793894
7-(1-hydroxynonyl)quinoline-2-carboxylic acid
CID 54296582
3-bromo-2-(3-ethyl-2-methoxyquinolin-7-yl)-2-methylpropanenitrile
CID 59393221
4-[(1S)-1-hydroxybutyl]benzene-1,2-diol;4-[(1R)-1-hydroxybutyl]benzene-1,2-diol
CID 162227064
cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol
CID 59474826
2-(3-ethyl-2-methoxyquinolin-7-yl)-3-(3-hydroxyphenyl)-2-methylpropanenitrile
CID 59392990
1-(3-butoxy-4-methoxyphenyl)butan-1-ol
CID 83951524
1-chrysen-2-ylbutan-1-ol
CID 88920736

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol?
The IUPAC name of 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol (CID 59393145) is 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol.
What is the SMILES notation for 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol?
The canonical SMILES for 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol is CCCC(O)c1ccc2cc(CC)c(OC)nc2c1.
What is the InChIKey of 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol?
The InChIKey is BIUPARRLGGOAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-4-6-15(18)13-8-7-12-9-11(5-2)16(19-3)17-14(12)10-13/h7-10,15,18H,4-6H2,1-3H3.
What are the key properties of 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol?
1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol has a molecular weight of 259.35 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-methoxyquinolin-7-yl)butan-1-ol is sourced from PubChem (CID 59393145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).