4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol

C17H21NO2 — CID 65161611

IUPAC4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol
SMILESOC(CCCC1CCCO1)c1ccc2ncccc2c1
InChIInChI=1S/C17H21NO2/c19-17(7-1-5-15-6-3-11-20-15)14-8-9-16-13(12-14)4-2-10-18-16/h2,4,8-10,12,15,17,19H,1,3,5-7,11H2
InChIKeyKJSMFCZKNGJHKZ-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.62
Rot. Bonds5

About 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol

4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol (PubChem CID 65161611) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol.

Molecular Properties

Compound Name4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol
PubChem CID65161611
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol
SMILESOC(CCCC1CCCO1)c1ccc2ncccc2c1
InChIInChI=1S/C17H21NO2/c19-17(7-1-5-15-6-3-11-20-15)14-8-9-16-13(12-14)4-2-10-18-16/h2,4,8-10,12,15,17,19H,1,3,5-7,11H2
InChIKeyKJSMFCZKNGJHKZ-UHFFFAOYSA-N
XLogP3.62
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-amine
CID 65164208
4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-one
CID 65167269
[4-(oxolan-2-yl)-1-quinoxalin-6-ylbutyl]hydrazine
CID 105221924
2-cycloheptyl-1-quinolin-6-ylethanol
CID 115826801
1-(4-chloro-3-fluorophenyl)-4-(oxolan-2-yl)butan-1-ol
CID 65161658
3-pyrrolidin-1-yl-1-quinolin-6-ylpropan-1-ol
CID 144811689
4-phenyl-1-quinolin-6-ylbutan-1-ol
CID 63097205
1-(2-methyl-4-pyridinyl)-3-(oxolan-2-yl)propan-1-ol
CID 106756236
4,4,4-trifluoro-1-quinolin-6-ylbutan-1-ol
CID 64566958
N-methyl-4-(oxolan-2-yl)-1-quinoxalin-6-ylbutan-1-amine
CID 65164718
[(2S)-2-hydroxy-2-quinolin-6-ylethyl]azanium
CID 7016270
1-(6-methyl-3-pyridinyl)-3-(oxolan-2-yl)propan-1-ol
CID 104822985

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol?
The IUPAC name of 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol (CID 65161611) is 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol.
What is the SMILES notation for 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol?
The canonical SMILES for 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol is OC(CCCC1CCCO1)c1ccc2ncccc2c1.
What is the InChIKey of 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol?
The InChIKey is KJSMFCZKNGJHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c19-17(7-1-5-15-6-3-11-20-15)14-8-9-16-13(12-14)4-2-10-18-16/h2,4,8-10,12,15,17,19H,1,3,5-7,11H2.
What are the key properties of 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol?
4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol has a molecular weight of 271.36 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-ol is sourced from PubChem (CID 65161611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).