2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine

C14H8F3NO — CID 135035008

IUPAC2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccnc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C14H8F3NO/c15-14(16,17)10-5-6-18-11(8-10)13-7-9-3-1-2-4-12(9)19-13/h1-8H
InChIKeyFZESLJIXTVEUHN-UHFFFAOYSA-N
MW263.22 g/mol
LogP4.51
Rot. Bonds1

About 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine

2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine (PubChem CID 135035008) has the molecular formula C14H8F3NO and a molecular weight of 263.22 g/mol. Its IUPAC name is 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine
PubChem CID135035008
Molecular FormulaC14H8F3NO
Molecular Weight263.22 g/mol
Exact Mass263.06
IUPAC Name2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccnc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C14H8F3NO/c15-14(16,17)10-5-6-18-11(8-10)13-7-9-3-1-2-4-12(9)19-13/h1-8H
InChIKeyFZESLJIXTVEUHN-UHFFFAOYSA-N
XLogP4.51
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-(4-Fluorophenyl)furo[3,2-b]pyridin-2-yl]pyridine
CID 10935149
(-)-Dimethyl-{2-[3-((R)-1-pyridin-2-yl-ethyl)-benzofuran-2-yl]-ethyl}-amine
CID 44247935
[5-(4-Fluoro-phenyl)-furan-2-ylmethyl]-pyridin-2-ylmethyl-amine
CID 6464045
6-[5-(4-Carbamimidoylphenyl)-2-furyl]pyridine-3-carboxamidine
CID 9817976
6-[5-[(4-Carbamimidoylphenyl)methyl]furan-2-yl]pyridine-3-carboximidamide
CID 10022614
3-(Benzofuran-2-ylmethylene)anabaseine
CID 10338609
6-[5-(5-Carbamimidoyl-2-pyridyl)-2-furyl]pyridine-3-carboxamidine
CID 10870488
1-((6-(5-Cyclohexylbenzofuran-2-yl)pyridin-3-yl)methyl)azetidine-3-carboxylic acid
CID 16737509
3-Fluoro-5-(5-(2-pyridyl)-2-furyl)-benzonitrile
CID 21942492
4-(2-Benzofuranyl)pyridine
CID 65590
6-[5-(3-Carbamimidoylphenyl)furan-2-yl]pyridine-3-carboximidamide
CID 10946678
N-(3-pyridylmethyl){5-[3-(trifluoromethyl)phenyl]-2-furyl}methanamine
CID 16044337

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine (CID 135035008) is 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine is FC(F)(F)c1ccnc(-c2cc3ccccc3o2)c1.
What is the InChIKey of 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine?
The InChIKey is FZESLJIXTVEUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F3NO/c15-14(16,17)10-5-6-18-11(8-10)13-7-9-3-1-2-4-12(9)19-13/h1-8H.
What are the key properties of 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine?
2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine has a molecular weight of 263.22 g/mol, XLogP of 4.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-2-yl)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 135035008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).