3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol

C16H19NO2 — CID 79618810

IUPAC3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol
SMILESCc1ccc2cccc(OC3CCCC(O)C3)c2n1
InChIInChI=1S/C16H19NO2/c1-11-8-9-12-4-2-7-15(16(12)17-11)19-14-6-3-5-13(18)10-14/h2,4,7-9,13-14,18H,3,5-6,10H2,1H3
InChIKeyUEIMPDZVRPSXIO-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.23
Rot. Bonds2

About 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol

3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol (PubChem CID 79618810) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol.

Molecular Properties

Compound Name3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol
PubChem CID79618810
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol
SMILESCc1ccc2cccc(OC3CCCC(O)C3)c2n1
InChIInChI=1S/C16H19NO2/c1-11-8-9-12-4-2-7-15(16(12)17-11)19-14-6-3-5-13(18)10-14/h2,4,7-9,13-14,18H,3,5-6,10H2,1H3
InChIKeyUEIMPDZVRPSXIO-UHFFFAOYSA-N
XLogP3.23
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol?
The IUPAC name of 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol (CID 79618810) is 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol.
What is the SMILES notation for 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol?
The canonical SMILES for 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol is Cc1ccc2cccc(OC3CCCC(O)C3)c2n1.
What is the InChIKey of 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol?
The InChIKey is UEIMPDZVRPSXIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11-8-9-12-4-2-7-15(16(12)17-11)19-14-6-3-5-13(18)10-14/h2,4,7-9,13-14,18H,3,5-6,10H2,1H3.
What are the key properties of 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol?
3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol has a molecular weight of 257.33 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylquinolin-8-yl)oxycyclohexan-1-ol is sourced from PubChem (CID 79618810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).