N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide

C26H24F3N3O2 — CID 46948465

IUPACN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide
SMILESCCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccc(C)cc1
InChIInChI=1S/C26H24F3N3O2/c1-4-21-24(31(3)25(33)19-11-7-17(2)8-12-19)32-15-5-6-22(23(32)30-21)34-16-18-9-13-20(14-10-18)26(27,28)29/h5-15H,4,16H2,1-3H3
InChIKeyVRUXXPFDAXMPQD-UHFFFAOYSA-N
MW467.49 g/mol
LogP6.08
Rot. Bonds6

About N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide

N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide (PubChem CID 46948465) has the molecular formula C26H24F3N3O2 and a molecular weight of 467.49 g/mol. Its IUPAC name is N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide
PubChem CID46948465
Molecular FormulaC26H24F3N3O2
Molecular Weight467.49 g/mol
Exact Mass467.18
IUPAC NameN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide
SMILESCCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccc(C)cc1
InChIInChI=1S/C26H24F3N3O2/c1-4-21-24(31(3)25(33)19-11-7-17(2)8-12-19)32-15-5-6-22(23(32)30-21)34-16-18-9-13-20(14-10-18)26(27,28)29/h5-15H,4,16H2,1-3H3
InChIKeyVRUXXPFDAXMPQD-UHFFFAOYSA-N
XLogP6.08
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.49
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide 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 N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide?
The IUPAC name of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide (CID 46948465) is N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide.
What is the SMILES notation for N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide?
The canonical SMILES for N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide is CCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccc(C)cc1.
What is the InChIKey of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide?
The InChIKey is VRUXXPFDAXMPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24F3N3O2/c1-4-21-24(31(3)25(33)19-11-7-17(2)8-12-19)32-15-5-6-22(23(32)30-21)34-16-18-9-13-20(14-10-18)26(27,28)29/h5-15H,4,16H2,1-3H3.
What are the key properties of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide?
N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide has a molecular weight of 467.49 g/mol, XLogP of 6.08, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N,4-dimethylbenzamide is sourced from PubChem (CID 46948465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).