4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine

C23H19FN4O — CID 44521026

IUPAC4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine
SMILESCc1cc(Oc2ccnc(Nc3ccc(F)cc3)c2)c(-c2ccccn2)nc1C
InChIInChI=1S/C23H19FN4O/c1-15-13-21(23(27-16(15)2)20-5-3-4-11-25-20)29-19-10-12-26-22(14-19)28-18-8-6-17(24)7-9-18/h3-14H,1-2H3,(H,26,28)
InChIKeyGEDJWDMJHOZAHV-UHFFFAOYSA-N
MW386.43 g/mol
LogP5.83
Rot. Bonds5

About 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine

4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine (PubChem CID 44521026) has the molecular formula C23H19FN4O and a molecular weight of 386.43 g/mol. Its IUPAC name is 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine
PubChem CID44521026
Molecular FormulaC23H19FN4O
Molecular Weight386.43 g/mol
Exact Mass386.15
IUPAC Name4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine
SMILESCc1cc(Oc2ccnc(Nc3ccc(F)cc3)c2)c(-c2ccccn2)nc1C
InChIInChI=1S/C23H19FN4O/c1-15-13-21(23(27-16(15)2)20-5-3-4-11-25-20)29-19-10-12-26-22(14-19)28-18-8-6-17(24)7-9-18/h3-14H,1-2H3,(H,26,28)
InChIKeyGEDJWDMJHOZAHV-UHFFFAOYSA-N
XLogP5.83
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.43
LogP ≤ 55.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine?
The IUPAC name of 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine (CID 44521026) is 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine is Cc1cc(Oc2ccnc(Nc3ccc(F)cc3)c2)c(-c2ccccn2)nc1C.
What is the InChIKey of 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine?
The InChIKey is GEDJWDMJHOZAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4O/c1-15-13-21(23(27-16(15)2)20-5-3-4-11-25-20)29-19-10-12-26-22(14-19)28-18-8-6-17(24)7-9-18/h3-14H,1-2H3,(H,26,28).
What are the key properties of 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine?
4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine has a molecular weight of 386.43 g/mol, XLogP of 5.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(4-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 44521026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).