2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine

C29H17F6N — CID 169293774

IUPAC2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc(C(F)(F)F)cc5)nc4)ccc3c2)cc1
InChIInChI=1S/C29H17F6N/c30-28(31,32)25-10-5-18(6-11-25)20-1-2-22-16-23(4-3-21(22)15-20)24-9-14-27(36-17-24)19-7-12-26(13-8-19)29(33,34)35/h1-17H
InChIKeyBFWULWJUGPPLEZ-UHFFFAOYSA-N
MW493.45 g/mol
LogP9.27
Rot. Bonds3

About 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine

2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine (PubChem CID 169293774) has the molecular formula C29H17F6N and a molecular weight of 493.45 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
PubChem CID169293774
Molecular FormulaC29H17F6N
Molecular Weight493.45 g/mol
Exact Mass493.13
IUPAC Name2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc(C(F)(F)F)cc5)nc4)ccc3c2)cc1
InChIInChI=1S/C29H17F6N/c30-28(31,32)25-10-5-18(6-11-25)20-1-2-22-16-23(4-3-21(22)15-20)24-9-14-27(36-17-24)19-7-12-26(13-8-19)29(33,34)35/h1-17H
InChIKeyBFWULWJUGPPLEZ-UHFFFAOYSA-N
XLogP9.27
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.45
LogP ≤ 59.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

trimethyl-[4-[5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]-2-pyridinyl]phenyl]silane
CID 169293659
2-naphthalen-2-yl-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
CID 169293608
7-[3,5-bis(trifluoromethyl)phenyl]-3-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]quinoline
CID 169293501
[4-[5-[7-[3,5-bis(trifluoromethyl)phenyl]naphthalen-2-yl]-2-pyridinyl]phenyl]-trimethylsilane
CID 169294031
4-[4-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]phenyl]pyridine
CID 169293640
3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293864
2-[4-(trifluoromethyl)phenyl]naphthalene
CID 11448652
2-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]naphthalene
CID 171056262
5-ethenyl-2-[4-(trifluoromethyl)phenyl]pyridine
CID 175646912
3-(4-quinolin-3-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293562
3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293945
2,4-bis[4-(trifluoromethyl)phenyl]pyridine
CID 134617794

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine?
The IUPAC name of 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine (CID 169293774) is 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine.
What is the SMILES notation for 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine?
The canonical SMILES for 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine is FC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc(C(F)(F)F)cc5)nc4)ccc3c2)cc1.
What is the InChIKey of 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine?
The InChIKey is BFWULWJUGPPLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H17F6N/c30-28(31,32)25-10-5-18(6-11-25)20-1-2-22-16-23(4-3-21(22)15-20)24-9-14-27(36-17-24)19-7-12-26(13-8-19)29(33,34)35/h1-17H.
What are the key properties of 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine?
2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine has a molecular weight of 493.45 g/mol, XLogP of 9.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine is sourced from PubChem (CID 169293774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).