oxan-3-yl(quinolin-7-yl)methanol

C15H17NO2 — CID 81216710

IUPACoxan-3-yl(quinolin-7-yl)methanol
SMILESOC(c1ccc2cccnc2c1)C1CCCOC1
InChIInChI=1S/C15H17NO2/c17-15(13-4-2-8-18-10-13)12-6-5-11-3-1-7-16-14(11)9-12/h1,3,5-7,9,13,15,17H,2,4,8,10H2
InChIKeyLYBSICJYCGPJPZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.69
Rot. Bonds2

About oxan-3-yl(quinolin-7-yl)methanol

oxan-3-yl(quinolin-7-yl)methanol (PubChem CID 81216710) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is oxan-3-yl(quinolin-7-yl)methanol.

Molecular Properties

Compound Nameoxan-3-yl(quinolin-7-yl)methanol
PubChem CID81216710
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Nameoxan-3-yl(quinolin-7-yl)methanol
SMILESOC(c1ccc2cccnc2c1)C1CCCOC1
InChIInChI=1S/C15H17NO2/c17-15(13-4-2-8-18-10-13)12-6-5-11-3-1-7-16-14(11)9-12/h1,3,5-7,9,13,15,17H,2,4,8,10H2
InChIKeyLYBSICJYCGPJPZ-UHFFFAOYSA-N
XLogP2.69
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

oxolan-3-yl(quinolin-7-yl)methanol
CID 81215665
oxan-3-yl(quinolin-6-yl)methanol
CID 81215748
oxan-3-yl(quinolin-7-yl)methanamine
CID 81231409
cycloheptyl(quinolin-7-yl)methanol
CID 81216722
(3-methylcyclopentyl)-quinolin-7-ylmethanol
CID 81220222
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-quinolin-7-ylmethanol
CID 115997893
(3-aminophenyl)-(oxan-3-yl)methanol
CID 107136268
oxan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanol
CID 63015264
N-[oxan-3-yl(quinolin-6-yl)methyl]ethanamine
CID 81231200
(4-bromophenyl)-(oxan-3-yl)methanol
CID 63015439
(3-bromo-4-fluorophenyl)-(oxan-3-yl)methanol
CID 79746537
1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
CID 81229901

Frequently Asked Questions

What is the IUPAC name of oxan-3-yl(quinolin-7-yl)methanol?
The IUPAC name of oxan-3-yl(quinolin-7-yl)methanol (CID 81216710) is oxan-3-yl(quinolin-7-yl)methanol.
What is the SMILES notation for oxan-3-yl(quinolin-7-yl)methanol?
The canonical SMILES for oxan-3-yl(quinolin-7-yl)methanol is OC(c1ccc2cccnc2c1)C1CCCOC1.
What is the InChIKey of oxan-3-yl(quinolin-7-yl)methanol?
The InChIKey is LYBSICJYCGPJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c17-15(13-4-2-8-18-10-13)12-6-5-11-3-1-7-16-14(11)9-12/h1,3,5-7,9,13,15,17H,2,4,8,10H2.
What are the key properties of oxan-3-yl(quinolin-7-yl)methanol?
oxan-3-yl(quinolin-7-yl)methanol has a molecular weight of 243.31 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-3-yl(quinolin-7-yl)methanol is sourced from PubChem (CID 81216710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).