5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine

C23H19FN4 — CID 11682194

IUPAC5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1ccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)cn1
InChIInChI=1S/C23H19FN4/c24-20-8-5-16(6-9-20)22(19-7-10-21(25)28-15-19)23(17-3-1-11-26-13-17)18-4-2-12-27-14-18/h1-15,22-23H,(H2,25,28)
InChIKeyHJIUWEFUXIKZEQ-UHFFFAOYSA-N
MW370.43 g/mol
LogP4.56
Rot. Bonds5

About 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine

5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine (PubChem CID 11682194) has the molecular formula C23H19FN4 and a molecular weight of 370.43 g/mol. Its IUPAC name is 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
PubChem CID11682194
Molecular FormulaC23H19FN4
Molecular Weight370.43 g/mol
Exact Mass370.16
IUPAC Name5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1ccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)cn1
InChIInChI=1S/C23H19FN4/c24-20-8-5-16(6-9-20)22(19-7-10-21(25)28-15-19)23(17-3-1-11-26-13-17)18-4-2-12-27-14-18/h1-15,22-23H,(H2,25,28)
InChIKeyHJIUWEFUXIKZEQ-UHFFFAOYSA-N
XLogP4.56
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]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 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The IUPAC name of 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine (CID 11682194) is 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine.
What is the SMILES notation for 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The canonical SMILES for 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine is Nc1ccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)cn1.
What is the InChIKey of 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The InChIKey is HJIUWEFUXIKZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4/c24-20-8-5-16(6-9-20)22(19-7-10-21(25)28-15-19)23(17-3-1-11-26-13-17)18-4-2-12-27-14-18/h1-15,22-23H,(H2,25,28).
What are the key properties of 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine has a molecular weight of 370.43 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine is sourced from PubChem (CID 11682194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).