2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine

C11H7Cl2FN2 — CID 130088674

IUPAC2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine
SMILESNc1cc(F)cnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C11H7Cl2FN2/c12-8-3-1-2-7(10(8)13)11-9(15)4-6(14)5-16-11/h1-5H,15H2
InChIKeyXXAGKUQCFCSCHU-UHFFFAOYSA-N
MW257.10 g/mol
LogP3.78
Rot. Bonds1

About 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine

2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine (PubChem CID 130088674) has the molecular formula C11H7Cl2FN2 and a molecular weight of 257.10 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine
PubChem CID130088674
Molecular FormulaC11H7Cl2FN2
Molecular Weight257.10 g/mol
Exact Mass256.00
IUPAC Name2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine
SMILESNc1cc(F)cnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C11H7Cl2FN2/c12-8-3-1-2-7(10(8)13)11-9(15)4-6(14)5-16-11/h1-5H,15H2
InChIKeyXXAGKUQCFCSCHU-UHFFFAOYSA-N
XLogP3.78
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.10
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine?
The IUPAC name of 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine (CID 130088674) is 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine is Nc1cc(F)cnc1-c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine?
The InChIKey is XXAGKUQCFCSCHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2FN2/c12-8-3-1-2-7(10(8)13)11-9(15)4-6(14)5-16-11/h1-5H,15H2.
What are the key properties of 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine?
2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine has a molecular weight of 257.10 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-5-fluoropyridin-3-amine is sourced from PubChem (CID 130088674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).