phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone

C19H12F3NO — CID 135024385

IUPACphenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone
SMILESO=C(c1ccccc1)c1ccc(C(F)(F)F)cc1-c1ccccn1
InChIInChI=1S/C19H12F3NO/c20-19(21,22)14-9-10-15(18(24)13-6-2-1-3-7-13)16(12-14)17-8-4-5-11-23-17/h1-12H
InChIKeyNZFKAOXVEOCRFV-UHFFFAOYSA-N
MW327.31 g/mol
LogP5.00
Rot. Bonds3

About phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone

phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone (PubChem CID 135024385) has the molecular formula C19H12F3NO and a molecular weight of 327.31 g/mol. Its IUPAC name is phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone.

Molecular Properties

Compound Namephenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone
PubChem CID135024385
Molecular FormulaC19H12F3NO
Molecular Weight327.31 g/mol
Exact Mass327.09
IUPAC Namephenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone
SMILESO=C(c1ccccc1)c1ccc(C(F)(F)F)cc1-c1ccccn1
InChIInChI=1S/C19H12F3NO/c20-19(21,22)14-9-10-15(18(24)13-6-2-1-3-7-13)16(12-14)17-8-4-5-11-23-17/h1-12H
InChIKeyNZFKAOXVEOCRFV-UHFFFAOYSA-N
XLogP5.00
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.31
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Benzoylpyridine
CID 26731
Jwh 307
CID 16049783
(1-hexyl-5-phenyl-1H-pyrrol-3-yl)(naphthalen-1-yl)methanone
CID 44418307
2-Benzoylpyridine
CID 7038
Jwh-368
CID 44418331
(4-Fluorophenyl)(pyridin-4-yl)methanone
CID 7023019
(5-(4-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl)(naphthalen-1-yl)methanone
CID 44418355
N-(3,5-bis(trifluoromethyl)benzyl)-N,7-dimethyl-8-oxo-5-p-tolyl-7,8-dihydro-1,7-naphthyridine-6-carboxamide
CID 9871754
naphthalen-1-yl(1-pentyl-5-phenyl-1H-pyrrol-3-yl)methanone
CID 44418304
Jwh-146
CID 44418308
Jwh-370
CID 44418312
naphthalen-1-yl(1-pentyl-5-(4-(trifluoromethyl)phenyl)-1H-pyrrol-3-yl)methanone
CID 44418368

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone?
The IUPAC name of phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone (CID 135024385) is phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone.
What is the SMILES notation for phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone?
The canonical SMILES for phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone is O=C(c1ccccc1)c1ccc(C(F)(F)F)cc1-c1ccccn1.
What is the InChIKey of phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone?
The InChIKey is NZFKAOXVEOCRFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3NO/c20-19(21,22)14-9-10-15(18(24)13-6-2-1-3-7-13)16(12-14)17-8-4-5-11-23-17/h1-12H.
What are the key properties of phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone?
phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone has a molecular weight of 327.31 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]methanone is sourced from PubChem (CID 135024385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).