8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline

C14H13ClN2O — CID 54907879

IUPAC8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
SMILESClc1ccc(Oc2cccc3c2NCCC3)nc1
InChIInChI=1S/C14H13ClN2O/c15-11-6-7-13(17-9-11)18-12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5-7,9,16H,2,4,8H2
InChIKeyGXVYBKMKOOZYNE-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.89
Rot. Bonds2

About 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline

8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 54907879) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
PubChem CID54907879
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC Name8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
SMILESClc1ccc(Oc2cccc3c2NCCC3)nc1
InChIInChI=1S/C14H13ClN2O/c15-11-6-7-13(17-9-11)18-12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5-7,9,16H,2,4,8H2
InChIKeyGXVYBKMKOOZYNE-UHFFFAOYSA-N
XLogP3.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-[(5-fluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 61313548
8-[(5-tert-butyl-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 107875268
8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
CID 61025631
8-(2,4-dichlorophenoxy)-1,2,3,4-tetrahydroquinoline
CID 139601365
8-pyridin-4-yloxy-1,2,3,4-tetrahydroquinoline
CID 54908431
8-(2-methylpyrimidin-4-yl)oxy-1,2,3,4-tetrahydroquinoline
CID 62770238
8-[(5-bromo-3-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 103582950
8-[(6-ethoxy-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 63589905
8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 112676286
2-(1,2,3,4-tetrahydroquinolin-8-yloxy)quinazoline
CID 114789583
5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide
CID 62494221
8-(6-propoxypyrimidin-4-yl)oxy-1,2,3,4-tetrahydroquinoline
CID 66332592

Frequently Asked Questions

What is the IUPAC name of 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline (CID 54907879) is 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline is Clc1ccc(Oc2cccc3c2NCCC3)nc1.
What is the InChIKey of 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is GXVYBKMKOOZYNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c15-11-6-7-13(17-9-11)18-12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5-7,9,16H,2,4,8H2.
What are the key properties of 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 260.72 g/mol, XLogP of 3.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 54907879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).