8-[(2-chloro-4-pyridinyl)oxy]quinoline

C14H9ClN2O — CID 63777963

IUPAC8-[(2-chloro-4-pyridinyl)oxy]quinoline
SMILESClc1cc(Oc2cccc3cccnc23)ccn1
InChIInChI=1S/C14H9ClN2O/c15-13-9-11(6-8-16-13)18-12-5-1-3-10-4-2-7-17-14(10)12/h1-9H
InChIKeyAVGJBDORHHZVIM-UHFFFAOYSA-N
MW256.69 g/mol
LogP4.08
Rot. Bonds2

About 8-[(2-chloro-4-pyridinyl)oxy]quinoline

8-[(2-chloro-4-pyridinyl)oxy]quinoline (PubChem CID 63777963) has the molecular formula C14H9ClN2O and a molecular weight of 256.69 g/mol. Its IUPAC name is 8-[(2-chloro-4-pyridinyl)oxy]quinoline.

Molecular Properties

Compound Name8-[(2-chloro-4-pyridinyl)oxy]quinoline
PubChem CID63777963
Molecular FormulaC14H9ClN2O
Molecular Weight256.69 g/mol
Exact Mass256.04
IUPAC Name8-[(2-chloro-4-pyridinyl)oxy]quinoline
SMILESClc1cc(Oc2cccc3cccnc23)ccn1
InChIInChI=1S/C14H9ClN2O/c15-13-9-11(6-8-16-13)18-12-5-1-3-10-4-2-7-17-14(10)12/h1-9H
InChIKeyAVGJBDORHHZVIM-UHFFFAOYSA-N
XLogP4.08
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

7-[(2-chloro-4-pyridinyl)oxy]quinoline
CID 107313588
2-chloro-4-(2-methoxyphenoxy)pyridine
CID 63777956
8-[(3,5,6-trichloro-2-pyridinyl)oxy]quinoline
CID 102749564
2-methoxy-4-quinolin-8-yloxyaniline
CID 63678209
8-[4-chloro-2-(chloromethyl)phenoxy]quinoline
CID 114847000
8-[(3-bromo-5-chloro-2-pyridinyl)oxy]quinoline
CID 114837621
8-(6-naphthalen-2-yloxypyrimidin-4-yl)oxyquinoline
CID 126961639
4-quinolin-8-yloxybenzoic acid
CID 28825287
8-(chloromethoxy)quinoline
CID 79531226
CID 137322014
CID 137322014
8-(6-chloro-2-propylpyrimidin-4-yl)oxyquinoline
CID 80938307
3-nitro-5-quinolin-8-yloxyaniline
CID 80874690

Frequently Asked Questions

What is the IUPAC name of 8-[(2-chloro-4-pyridinyl)oxy]quinoline?
The IUPAC name of 8-[(2-chloro-4-pyridinyl)oxy]quinoline (CID 63777963) is 8-[(2-chloro-4-pyridinyl)oxy]quinoline.
What is the SMILES notation for 8-[(2-chloro-4-pyridinyl)oxy]quinoline?
The canonical SMILES for 8-[(2-chloro-4-pyridinyl)oxy]quinoline is Clc1cc(Oc2cccc3cccnc23)ccn1.
What is the InChIKey of 8-[(2-chloro-4-pyridinyl)oxy]quinoline?
The InChIKey is AVGJBDORHHZVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O/c15-13-9-11(6-8-16-13)18-12-5-1-3-10-4-2-7-17-14(10)12/h1-9H.
What are the key properties of 8-[(2-chloro-4-pyridinyl)oxy]quinoline?
8-[(2-chloro-4-pyridinyl)oxy]quinoline has a molecular weight of 256.69 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-chloro-4-pyridinyl)oxy]quinoline is sourced from PubChem (CID 63777963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).