4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine

C19H14F3N5 — CID 129315788

IUPAC4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine
SMILESCn1nc(C(F)(F)F)cc1-c1ccnc(-c2ncc(-c3ccccc3)[nH]2)c1
InChIInChI=1S/C19H14F3N5/c1-27-16(10-17(26-27)19(20,21)22)13-7-8-23-14(9-13)18-24-11-15(25-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25)
InChIKeyGSERLPTVMOBWHD-UHFFFAOYSA-N
MW369.35 g/mol
LogP4.56
Rot. Bonds3

About 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine

4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine (PubChem CID 129315788) has the molecular formula C19H14F3N5 and a molecular weight of 369.35 g/mol. Its IUPAC name is 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine.

Molecular Properties

Compound Name4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine
PubChem CID129315788
Molecular FormulaC19H14F3N5
Molecular Weight369.35 g/mol
Exact Mass369.12
IUPAC Name4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine
SMILESCn1nc(C(F)(F)F)cc1-c1ccnc(-c2ncc(-c3ccccc3)[nH]2)c1
InChIInChI=1S/C19H14F3N5/c1-27-16(10-17(26-27)19(20,21)22)13-7-8-23-14(9-13)18-24-11-15(25-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25)
InChIKeyGSERLPTVMOBWHD-UHFFFAOYSA-N
XLogP4.56
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.35
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine?
The IUPAC name of 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine (CID 129315788) is 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine.
What is the SMILES notation for 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine?
The canonical SMILES for 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine is Cn1nc(C(F)(F)F)cc1-c1ccnc(-c2ncc(-c3ccccc3)[nH]2)c1.
What is the InChIKey of 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine?
The InChIKey is GSERLPTVMOBWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N5/c1-27-16(10-17(26-27)19(20,21)22)13-7-8-23-14(9-13)18-24-11-15(25-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25).
What are the key properties of 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine?
4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine has a molecular weight of 369.35 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-(5-phenyl-1H-imidazol-2-yl)pyridine is sourced from PubChem (CID 129315788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).