2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine

C24H18F2N2 — CID 139188402

IUPAC2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine
SMILESFc1ccc([C@@H](c2ccccn2)[C@@H](c2ccc(F)cc2)c2ccccn2)cc1
InChIInChI=1S/C24H18F2N2/c25-19-11-7-17(8-12-19)23(21-5-1-3-15-27-21)24(22-6-2-4-16-28-22)18-9-13-20(26)14-10-18/h1-16,23-24H/t23-,24-/m0/s1
InChIKeyZNRZJGHHHBPXQZ-ZEQRLZLVSA-N
MW372.42 g/mol
LogP5.72
Rot. Bonds5

About 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine

2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine (PubChem CID 139188402) has the molecular formula C24H18F2N2 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine.

Molecular Properties

Compound Name2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine
PubChem CID139188402
Molecular FormulaC24H18F2N2
Molecular Weight372.42 g/mol
Exact Mass372.14
IUPAC Name2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine
SMILESFc1ccc([C@@H](c2ccccn2)[C@@H](c2ccc(F)cc2)c2ccccn2)cc1
InChIInChI=1S/C24H18F2N2/c25-19-11-7-17(8-12-19)23(21-5-1-3-15-27-21)24(22-6-2-4-16-28-22)18-9-13-20(26)14-10-18/h1-16,23-24H/t23-,24-/m0/s1
InChIKeyZNRZJGHHHBPXQZ-ZEQRLZLVSA-N
XLogP5.72
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.42
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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2,3-Diphenylpyrazine
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1,3-Bis(4-pyridyl)propane
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Frequently Asked Questions

What is the IUPAC name of 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine?
The IUPAC name of 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine (CID 139188402) is 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine.
What is the SMILES notation for 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine?
The canonical SMILES for 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine is Fc1ccc([C@@H](c2ccccn2)[C@@H](c2ccc(F)cc2)c2ccccn2)cc1.
What is the InChIKey of 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine?
The InChIKey is ZNRZJGHHHBPXQZ-ZEQRLZLVSA-N. The full InChI is InChI=1S/C24H18F2N2/c25-19-11-7-17(8-12-19)23(21-5-1-3-15-27-21)24(22-6-2-4-16-28-22)18-9-13-20(26)14-10-18/h1-16,23-24H/t23-,24-/m0/s1.
What are the key properties of 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine?
2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine has a molecular weight of 372.42 g/mol, XLogP of 5.72, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S,2S)-1,2-bis(4-fluorophenyl)-2-pyridin-2-ylethyl]pyridine is sourced from PubChem (CID 139188402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).