(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one

C19H15F3N2O — CID 102125723

IUPAC(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one
SMILESO=C(C[C@H](c1ccc(C(F)(F)F)cc1)n1cccn1)c1ccccc1
InChIInChI=1S/C19H15F3N2O/c20-19(21,22)16-9-7-14(8-10-16)17(24-12-4-11-23-24)13-18(25)15-5-2-1-3-6-15/h1-12,17H,13H2/t17-/m1/s1
InChIKeyCZMDEVWPLCXOSP-QGZVFWFLSA-N
MW344.34 g/mol
LogP4.76
Rot. Bonds5

About (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one

(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one (PubChem CID 102125723) has the molecular formula C19H15F3N2O and a molecular weight of 344.34 g/mol. Its IUPAC name is (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one.

Molecular Properties

Compound Name(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one
PubChem CID102125723
Molecular FormulaC19H15F3N2O
Molecular Weight344.34 g/mol
Exact Mass344.11
IUPAC Name(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one
SMILESO=C(C[C@H](c1ccc(C(F)(F)F)cc1)n1cccn1)c1ccccc1
InChIInChI=1S/C19H15F3N2O/c20-19(21,22)16-9-7-14(8-10-16)17(24-12-4-11-23-24)13-18(25)15-5-2-1-3-6-15/h1-12,17H,13H2/t17-/m1/s1
InChIKeyCZMDEVWPLCXOSP-QGZVFWFLSA-N
XLogP4.76
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.34
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-3-(4-methoxyphenyl)-1-phenyl-3-pyrazol-1-ylpropan-1-one
CID 102125729
(3R)-3-hydroxy-1-phenyl-3-[4-(trifluoromethyl)phenyl]propan-1-one
CID 101378731
N-(3-phenyl-3-pyrazol-1-ylpropanoyl)benzamide
CID 146165038
1-[3-oxo-3-phenyl-1-[4-(trifluoromethyl)phenyl]propyl]indole-3-carbonitrile
CID 177472474
(3R)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)propan-1-one
CID 40573311
(3S)-1,3-diphenyl-3-(3-phenylpyrazol-1-yl)propan-1-one
CID 139190876
(3S)-1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)-2-pyridinyl]propan-1-one
CID 157277176
CID 175394574
CID 175394574
(3R)-3-[4-[(1R)-3-oxo-1,3-diphenylpropyl]piperazin-1-yl]-1,3-diphenylpropan-1-one
CID 51617866
3-phenyl-3-pyrazol-1-ylpropanimidamide
CID 62778282
2-bromo-1-phenyl-2-[4-(trifluoromethyl)phenyl]ethanone
CID 54412235
1-phenyl-2-[[5-[5-(trifluoromethyl)-2-pyridinyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
CID 2746579

Frequently Asked Questions

What is the IUPAC name of (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one?
The IUPAC name of (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one (CID 102125723) is (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one.
What is the SMILES notation for (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one?
The canonical SMILES for (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one is O=C(C[C@H](c1ccc(C(F)(F)F)cc1)n1cccn1)c1ccccc1.
What is the InChIKey of (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one?
The InChIKey is CZMDEVWPLCXOSP-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H15F3N2O/c20-19(21,22)16-9-7-14(8-10-16)17(24-12-4-11-23-24)13-18(25)15-5-2-1-3-6-15/h1-12,17H,13H2/t17-/m1/s1.
What are the key properties of (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one?
(3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one has a molecular weight of 344.34 g/mol, XLogP of 4.76, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-phenyl-3-pyrazol-1-yl-3-[4-(trifluoromethyl)phenyl]propan-1-one is sourced from PubChem (CID 102125723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).