2,6-bis(4-fluorophenyl)-3,4-dihydropyridine

C17H13F2N — CID 123242959

IUPAC2,6-bis(4-fluorophenyl)-3,4-dihydropyridine
SMILESFc1ccc(C2=CCCC(c3ccc(F)cc3)=N2)cc1
InChIInChI=1S/C17H13F2N/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h2,4-11H,1,3H2
InChIKeyGKLCBZGJPLTAAA-UHFFFAOYSA-N
MW269.29 g/mol
LogP4.59
Rot. Bonds2

About 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine

2,6-bis(4-fluorophenyl)-3,4-dihydropyridine (PubChem CID 123242959) has the molecular formula C17H13F2N and a molecular weight of 269.29 g/mol. Its IUPAC name is 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine.

Molecular Properties

Compound Name2,6-bis(4-fluorophenyl)-3,4-dihydropyridine
PubChem CID123242959
Molecular FormulaC17H13F2N
Molecular Weight269.29 g/mol
Exact Mass269.10
IUPAC Name2,6-bis(4-fluorophenyl)-3,4-dihydropyridine
SMILESFc1ccc(C2=CCCC(c3ccc(F)cc3)=N2)cc1
InChIInChI=1S/C17H13F2N/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h2,4-11H,1,3H2
InChIKeyGKLCBZGJPLTAAA-UHFFFAOYSA-N
XLogP4.59
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,1-diphenylethan-1-imine
CID 555698
6,7-Diphenyldibenzo(E,G)(1,4)diazocine
CID 258179
2,5-diphenyl-3,4-dihydro-2H-pyrrole
CID 279812
Benzenamine, N-[bis(4-fluorophenyl)methylene]-
CID 2317228
N-(1-Phenylethylidene)-2-(trifluoromethyl)aniline
CID 12585592
1-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]methanimine
CID 16752924
2-Fluoro-N-((2-fluorophenyl)methylene)benzenemethanamine
CID 67464029
N-[1-(4-Fluorophenyl)ethylidene]benzenamine
CID 11241334
N-(1-(4-(Trifluoromethyl)phenyl)ethylidene)benzenamine
CID 11300013
Benzenamine, 4-fluoro-N-(1-phenylethylidene)-
CID 11310403
N-[4-(Trifluoromethyl)phenyl]-1-phenylethaneimine
CID 11780337
N-phenylbenzimidoyl fluoride
CID 13213151

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine?
The IUPAC name of 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine (CID 123242959) is 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine.
What is the SMILES notation for 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine?
The canonical SMILES for 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine is Fc1ccc(C2=CCCC(c3ccc(F)cc3)=N2)cc1.
What is the InChIKey of 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine?
The InChIKey is GKLCBZGJPLTAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F2N/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h2,4-11H,1,3H2.
What are the key properties of 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine?
2,6-bis(4-fluorophenyl)-3,4-dihydropyridine has a molecular weight of 269.29 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-fluorophenyl)-3,4-dihydropyridine is sourced from PubChem (CID 123242959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).