5-(2-chloro-4-fluorophenyl)pyridin-2-amine

C11H8ClFN2 — CID 50968681

IUPAC5-(2-chloro-4-fluorophenyl)pyridin-2-amine
SMILESNc1ccc(-c2ccc(F)cc2Cl)cn1
InChIInChI=1S/C11H8ClFN2/c12-10-5-8(13)2-3-9(10)7-1-4-11(14)15-6-7/h1-6H,(H2,14,15)
InChIKeyCFWQIGXKFOLDEM-UHFFFAOYSA-N
MW222.65 g/mol
LogP3.12
Rot. Bonds1

About 5-(2-chloro-4-fluorophenyl)pyridin-2-amine

5-(2-chloro-4-fluorophenyl)pyridin-2-amine (PubChem CID 50968681) has the molecular formula C11H8ClFN2 and a molecular weight of 222.65 g/mol. Its IUPAC name is 5-(2-chloro-4-fluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-chloro-4-fluorophenyl)pyridin-2-amine
PubChem CID50968681
Molecular FormulaC11H8ClFN2
Molecular Weight222.65 g/mol
Exact Mass222.04
IUPAC Name5-(2-chloro-4-fluorophenyl)pyridin-2-amine
SMILESNc1ccc(-c2ccc(F)cc2Cl)cn1
InChIInChI=1S/C11H8ClFN2/c12-10-5-8(13)2-3-9(10)7-1-4-11(14)15-6-7/h1-6H,(H2,14,15)
InChIKeyCFWQIGXKFOLDEM-UHFFFAOYSA-N
XLogP3.12
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-4-fluorophenyl)pyridin-2-amine?
The IUPAC name of 5-(2-chloro-4-fluorophenyl)pyridin-2-amine (CID 50968681) is 5-(2-chloro-4-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 5-(2-chloro-4-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 5-(2-chloro-4-fluorophenyl)pyridin-2-amine is Nc1ccc(-c2ccc(F)cc2Cl)cn1.
What is the InChIKey of 5-(2-chloro-4-fluorophenyl)pyridin-2-amine?
The InChIKey is CFWQIGXKFOLDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2/c12-10-5-8(13)2-3-9(10)7-1-4-11(14)15-6-7/h1-6H,(H2,14,15).
What are the key properties of 5-(2-chloro-4-fluorophenyl)pyridin-2-amine?
5-(2-chloro-4-fluorophenyl)pyridin-2-amine has a molecular weight of 222.65 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-4-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 50968681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).