3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine

C23H18FN3 — CID 69287333

IUPAC3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine
SMILESFc1ccc(C(Cc2cccnc2)c2cccnc2)c(-c2ccncc2)c1
InChIInChI=1S/C23H18FN3/c24-20-5-6-21(23(14-20)18-7-11-25-12-8-18)22(19-4-2-10-27-16-19)13-17-3-1-9-26-15-17/h1-12,14-16,22H,13H2
InChIKeySJIPNZFGKWGZAH-UHFFFAOYSA-N
MW355.42 g/mol
LogP5.05
Rot. Bonds5

About 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine

3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine (PubChem CID 69287333) has the molecular formula C23H18FN3 and a molecular weight of 355.42 g/mol. Its IUPAC name is 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine.

Molecular Properties

Compound Name3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine
PubChem CID69287333
Molecular FormulaC23H18FN3
Molecular Weight355.42 g/mol
Exact Mass355.15
IUPAC Name3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine
SMILESFc1ccc(C(Cc2cccnc2)c2cccnc2)c(-c2ccncc2)c1
InChIInChI=1S/C23H18FN3/c24-20-5-6-21(23(14-20)18-7-11-25-12-8-18)22(19-4-2-10-27-16-19)13-17-3-1-9-26-15-17/h1-12,14-16,22H,13H2
InChIKeySJIPNZFGKWGZAH-UHFFFAOYSA-N
XLogP5.05
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.42
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(4-fluoro-2-pyridin-3-ylphenyl)-2-pyridin-3-ylethyl]pyridine
CID 66829378
3-[1-(2-benzyl-4-fluorophenyl)-2-pyridin-3-ylethyl]pyridine
CID 69287318
3-[2-[4-fluoro-2-(4-fluorophenyl)phenyl]-1-pyridin-3-ylethyl]pyridine
CID 67264973
3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine
CID 176898824
3-[2-(2-fluorophenyl)-2-phenylethyl]pyridine
CID 176898821
1-(2-bromo-4-fluorophenyl)-2-pyridin-3-ylethanamine
CID 105034708
N-[1-(2,4-difluorophenyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 62802705
N-(3-fluorophenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425726
(1S)-2-(4-fluorophenyl)-1-pyridin-3-ylethanol
CID 93312266
3-(2,2-dipyridin-3-ylethyl)-2-(4-fluoro-2-methylphenyl)pyridine
CID 66829446
2,2-dipyridin-3-ylethanol
CID 57450821
(1S)-2-(4-fluorophenyl)-1-pyridin-3-ylethanamine
CID 93422741

Frequently Asked Questions

What is the IUPAC name of 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine?
The IUPAC name of 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine (CID 69287333) is 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine.
What is the SMILES notation for 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine?
The canonical SMILES for 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine is Fc1ccc(C(Cc2cccnc2)c2cccnc2)c(-c2ccncc2)c1.
What is the InChIKey of 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine?
The InChIKey is SJIPNZFGKWGZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3/c24-20-5-6-21(23(14-20)18-7-11-25-12-8-18)22(19-4-2-10-27-16-19)13-17-3-1-9-26-15-17/h1-12,14-16,22H,13H2.
What are the key properties of 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine?
3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine has a molecular weight of 355.42 g/mol, XLogP of 5.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(4-fluoro-2-pyridin-4-ylphenyl)-2-pyridin-3-ylethyl]pyridine is sourced from PubChem (CID 69287333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).