6-chloro-N-(4-fluorophenyl)pyridin-2-amine

C11H8ClFN2 — CID 11673008

IUPAC6-chloro-N-(4-fluorophenyl)pyridin-2-amine
SMILESFc1ccc(Nc2cccc(Cl)n2)cc1
InChIInChI=1S/C11H8ClFN2/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9/h1-7H,(H,14,15)
InChIKeyXYCVTLPNALADRL-UHFFFAOYSA-N
MW222.65 g/mol
LogP3.62
Rot. Bonds2

About 6-chloro-N-(4-fluorophenyl)pyridin-2-amine

6-chloro-N-(4-fluorophenyl)pyridin-2-amine (PubChem CID 11673008) has the molecular formula C11H8ClFN2 and a molecular weight of 222.65 g/mol. Its IUPAC name is 6-chloro-N-(4-fluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(4-fluorophenyl)pyridin-2-amine
PubChem CID11673008
Molecular FormulaC11H8ClFN2
Molecular Weight222.65 g/mol
Exact Mass222.04
IUPAC Name6-chloro-N-(4-fluorophenyl)pyridin-2-amine
SMILESFc1ccc(Nc2cccc(Cl)n2)cc1
InChIInChI=1S/C11H8ClFN2/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9/h1-7H,(H,14,15)
InChIKeyXYCVTLPNALADRL-UHFFFAOYSA-N
XLogP3.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 6-chloro-N-(4-fluorophenyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine (CID 11673008) is 6-chloro-N-(4-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine is Fc1ccc(Nc2cccc(Cl)n2)cc1.
What is the InChIKey of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine?
The InChIKey is XYCVTLPNALADRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2/c12-10-2-1-3-11(15-10)14-9-6-4-8(13)5-7-9/h1-7H,(H,14,15).
What are the key properties of 6-chloro-N-(4-fluorophenyl)pyridin-2-amine?
6-chloro-N-(4-fluorophenyl)pyridin-2-amine has a molecular weight of 222.65 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 11673008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).