2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine

C11H5Cl2F3N2 — CID 118830739

IUPAC2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine
SMILESFC(F)(F)c1cnc(-c2cc(Cl)cc(Cl)c2)nc1
InChIInChI=1S/C11H5Cl2F3N2/c12-8-1-6(2-9(13)3-8)10-17-4-7(5-18-10)11(14,15)16/h1-5H
InChIKeyWJAWGMKOGOVFJM-UHFFFAOYSA-N
MW293.08 g/mol
LogP4.47
Rot. Bonds1

About 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine

2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine (PubChem CID 118830739) has the molecular formula C11H5Cl2F3N2 and a molecular weight of 293.08 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine
PubChem CID118830739
Molecular FormulaC11H5Cl2F3N2
Molecular Weight293.08 g/mol
Exact Mass291.98
IUPAC Name2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine
SMILESFC(F)(F)c1cnc(-c2cc(Cl)cc(Cl)c2)nc1
InChIInChI=1S/C11H5Cl2F3N2/c12-8-1-6(2-9(13)3-8)10-17-4-7(5-18-10)11(14,15)16/h1-5H
InChIKeyWJAWGMKOGOVFJM-UHFFFAOYSA-N
XLogP4.47
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.08
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine 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

2-(3,4,5-trichlorophenyl)-5-(trifluoromethyl)pyrimidine
CID 118847643
2-(2,3,6-trichlorophenyl)-5-(trifluoromethyl)pyrimidine
CID 118802423
1,3-dichloro-5-[4-(trifluoromethyl)phenyl]benzene
CID 57139215
1-chloro-3,5-bis(trifluoromethyl)benzene
CID 2769405
[4-[5-(trifluoromethyl)pyrimidin-2-yl]-2-pyridinyl]methanamine
CID 122693562
3-fluoro-2-(2,3,4,5,6-pentachlorophenyl)-5-(trifluoromethyl)pyridine
CID 133090076
2-[3,5-bis(trifluoromethyl)phenyl]pyrimidine
CID 54057342
4-chloro-2-(3,5-dichlorophenyl)-5-iodopyrimidine
CID 66313466
5-(trifluoromethyl)pyrimidin-2-amine
CID 15273574
2-bromo-3-chloro-5-(trifluoromethyl)pyridine
CID 2736237
2,5-dichloro-3-[4-(trifluoromethyl)phenyl]pyridine
CID 119007781
[2-(2,3,4,5,6-pentachlorophenyl)-5-(trifluoromethyl)-3-pyridinyl]methanol
CID 118826276

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine?
The IUPAC name of 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine (CID 118830739) is 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine?
The canonical SMILES for 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine is FC(F)(F)c1cnc(-c2cc(Cl)cc(Cl)c2)nc1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine?
The InChIKey is WJAWGMKOGOVFJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F3N2/c12-8-1-6(2-9(13)3-8)10-17-4-7(5-18-10)11(14,15)16/h1-5H.
What are the key properties of 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine?
2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine has a molecular weight of 293.08 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-5-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 118830739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).