6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine

C23H19FN4 — CID 11703422

IUPAC6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1cccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)n1
InChIInChI=1S/C23H19FN4/c24-19-10-8-16(9-11-19)23(20-6-1-7-21(25)28-20)22(17-4-2-12-26-14-17)18-5-3-13-27-15-18/h1-15,22-23H,(H2,25,28)
InChIKeyPRKVKUYGNCTPOE-UHFFFAOYSA-N
MW370.43 g/mol
LogP4.56
Rot. Bonds5

About 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine

6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine (PubChem CID 11703422) has the molecular formula C23H19FN4 and a molecular weight of 370.43 g/mol. Its IUPAC name is 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
PubChem CID11703422
Molecular FormulaC23H19FN4
Molecular Weight370.43 g/mol
Exact Mass370.16
IUPAC Name6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1cccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)n1
InChIInChI=1S/C23H19FN4/c24-19-10-8-16(9-11-19)23(20-6-1-7-21(25)28-20)22(17-4-2-12-26-14-17)18-5-3-13-27-15-18/h1-15,22-23H,(H2,25,28)
InChIKeyPRKVKUYGNCTPOE-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

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The IUPAC name of 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine (CID 11703422) is 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine.
What is the SMILES notation for 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The canonical SMILES for 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine is Nc1cccc(C(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)n1.
What is the InChIKey of 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
The InChIKey is PRKVKUYGNCTPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4/c24-19-10-8-16(9-11-19)23(20-6-1-7-21(25)28-20)22(17-4-2-12-26-14-17)18-5-3-13-27-15-18/h1-15,22-23H,(H2,25,28).
What are the key properties of 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine?
6-[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 6-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridin-2-amine is sourced from PubChem (CID 11703422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).