2-chloro-6-naphthalen-1-yloxypyridin-4-amine

C15H11ClN2O — CID 56990425

IUPAC2-chloro-6-naphthalen-1-yloxypyridin-4-amine
SMILESNc1cc(Cl)nc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C15H11ClN2O/c16-14-8-11(17)9-15(18-14)19-13-7-3-5-10-4-1-2-6-12(10)13/h1-9H,(H2,17,18)
InChIKeyUTERQKWKWNFPTH-UHFFFAOYSA-N
MW270.72 g/mol
LogP4.26
Rot. Bonds2

About 2-chloro-6-naphthalen-1-yloxypyridin-4-amine

2-chloro-6-naphthalen-1-yloxypyridin-4-amine (PubChem CID 56990425) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is 2-chloro-6-naphthalen-1-yloxypyridin-4-amine.

Molecular Properties

Compound Name2-chloro-6-naphthalen-1-yloxypyridin-4-amine
PubChem CID56990425
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name2-chloro-6-naphthalen-1-yloxypyridin-4-amine
SMILESNc1cc(Cl)nc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C15H11ClN2O/c16-14-8-11(17)9-15(18-14)19-13-7-3-5-10-4-1-2-6-12(10)13/h1-9H,(H2,17,18)
InChIKeyUTERQKWKWNFPTH-UHFFFAOYSA-N
XLogP4.26
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-naphthalen-1-yloxypyridin-4-amine?
The IUPAC name of 2-chloro-6-naphthalen-1-yloxypyridin-4-amine (CID 56990425) is 2-chloro-6-naphthalen-1-yloxypyridin-4-amine.
What is the SMILES notation for 2-chloro-6-naphthalen-1-yloxypyridin-4-amine?
The canonical SMILES for 2-chloro-6-naphthalen-1-yloxypyridin-4-amine is Nc1cc(Cl)nc(Oc2cccc3ccccc23)c1.
What is the InChIKey of 2-chloro-6-naphthalen-1-yloxypyridin-4-amine?
The InChIKey is UTERQKWKWNFPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c16-14-8-11(17)9-15(18-14)19-13-7-3-5-10-4-1-2-6-12(10)13/h1-9H,(H2,17,18).
What are the key properties of 2-chloro-6-naphthalen-1-yloxypyridin-4-amine?
2-chloro-6-naphthalen-1-yloxypyridin-4-amine has a molecular weight of 270.72 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-naphthalen-1-yloxypyridin-4-amine is sourced from PubChem (CID 56990425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).