8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine

C14H10ClN3O — CID 79840623

IUPAC8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine
SMILESNc1ccc(Oc2ccncc2Cl)c2ncccc12
InChIInChI=1S/C14H10ClN3O/c15-10-8-17-7-5-12(10)19-13-4-3-11(16)9-2-1-6-18-14(9)13/h1-8H,16H2
InChIKeyPYWZKYZTWISIHJ-UHFFFAOYSA-N
MW271.71 g/mol
LogP3.66
Rot. Bonds2

About 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine

8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine (PubChem CID 79840623) has the molecular formula C14H10ClN3O and a molecular weight of 271.71 g/mol. Its IUPAC name is 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine.

Molecular Properties

Compound Name8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine
PubChem CID79840623
Molecular FormulaC14H10ClN3O
Molecular Weight271.71 g/mol
Exact Mass271.05
IUPAC Name8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine
SMILESNc1ccc(Oc2ccncc2Cl)c2ncccc12
InChIInChI=1S/C14H10ClN3O/c15-10-8-17-7-5-12(10)19-13-4-3-11(16)9-2-1-6-18-14(9)13/h1-8H,16H2
InChIKeyPYWZKYZTWISIHJ-UHFFFAOYSA-N
XLogP3.66
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.71
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

8-(2,3-dichlorophenoxy)quinolin-5-amine
CID 43450313
8-(4-chlorophenoxy)quinolin-5-amine
CID 43450277
8-(3,5-dichlorophenoxy)quinolin-5-amine
CID 43621813
8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine
CID 65209502
4-[(3-chloro-4-pyridinyl)oxy]-2,5-dimethylaniline
CID 79841207
8-(pyridin-3-ylmethoxy)quinolin-5-amine
CID 60863689
8-[(5-methyl-2-pyridinyl)oxy]quinolin-5-amine
CID 60864239
8-[(E)-3-chloroprop-2-enoxy]quinolin-5-amine
CID 107899466
5-(2,4,5-trichlorophenoxy)quinolin-8-amine
CID 43449630
8-[(3-chloro-2-fluorophenyl)methoxy]quinolin-5-amine
CID 102855349
4-quinolin-8-yloxypyridin-3-amine
CID 28890445
8-(2-fluoro-5-methylphenoxy)quinolin-5-amine
CID 64855173

Frequently Asked Questions

What is the IUPAC name of 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine?
The IUPAC name of 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine (CID 79840623) is 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine.
What is the SMILES notation for 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine?
The canonical SMILES for 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine is Nc1ccc(Oc2ccncc2Cl)c2ncccc12.
What is the InChIKey of 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine?
The InChIKey is PYWZKYZTWISIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O/c15-10-8-17-7-5-12(10)19-13-4-3-11(16)9-2-1-6-18-14(9)13/h1-8H,16H2.
What are the key properties of 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine?
8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine has a molecular weight of 271.71 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine is sourced from PubChem (CID 79840623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).