5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one

C19H19F3N4O — CID 16764304

IUPAC5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one
SMILESCCCN1C(=O)C(Nc2cccc(C)n2)(C(F)(F)F)N=C1c1ccccc1
InChIInChI=1S/C19H19F3N4O/c1-3-12-26-16(14-9-5-4-6-10-14)25-18(17(26)27,19(20,21)22)24-15-11-7-8-13(2)23-15/h4-11H,3,12H2,1-2H3,(H,23,24)
InChIKeyBBHPWGVDSYCADN-UHFFFAOYSA-N
MW376.38 g/mol
LogP3.76
Rot. Bonds5

About 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one

5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one (PubChem CID 16764304) has the molecular formula C19H19F3N4O and a molecular weight of 376.38 g/mol. Its IUPAC name is 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one.

Molecular Properties

Compound Name5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one
PubChem CID16764304
Molecular FormulaC19H19F3N4O
Molecular Weight376.38 g/mol
Exact Mass376.15
IUPAC Name5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one
SMILESCCCN1C(=O)C(Nc2cccc(C)n2)(C(F)(F)F)N=C1c1ccccc1
InChIInChI=1S/C19H19F3N4O/c1-3-12-26-16(14-9-5-4-6-10-14)25-18(17(26)27,19(20,21)22)24-15-11-7-8-13(2)23-15/h4-11H,3,12H2,1-2H3,(H,23,24)
InChIKeyBBHPWGVDSYCADN-UHFFFAOYSA-N
XLogP3.76
TPSA57.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one?
The IUPAC name of 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one (CID 16764304) is 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one.
What is the SMILES notation for 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one?
The canonical SMILES for 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one is CCCN1C(=O)C(Nc2cccc(C)n2)(C(F)(F)F)N=C1c1ccccc1.
What is the InChIKey of 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one?
The InChIKey is BBHPWGVDSYCADN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N4O/c1-3-12-26-16(14-9-5-4-6-10-14)25-18(17(26)27,19(20,21)22)24-15-11-7-8-13(2)23-15/h4-11H,3,12H2,1-2H3,(H,23,24).
What are the key properties of 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one?
5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one has a molecular weight of 376.38 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-methyl-2-pyridinyl)amino]-2-phenyl-3-propyl-5-(trifluoromethyl)imidazol-4-one is sourced from PubChem (CID 16764304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).