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

C24H21F3N4O2 — CID 46948337

IUPACN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide
SMILESCCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccncc1
InChIInChI=1S/C24H21F3N4O2/c1-3-19-22(30(2)23(32)17-10-12-28-13-11-17)31-14-4-5-20(21(31)29-19)33-15-16-6-8-18(9-7-16)24(25,26)27/h4-14H,3,15H2,1-2H3
InChIKeyIKJFCQSUXYLNRY-UHFFFAOYSA-N
MW454.45 g/mol
LogP5.17
Rot. Bonds6

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

N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide (PubChem CID 46948337) has the molecular formula C24H21F3N4O2 and a molecular weight of 454.45 g/mol. Its IUPAC name is N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide
PubChem CID46948337
Molecular FormulaC24H21F3N4O2
Molecular Weight454.45 g/mol
Exact Mass454.16
IUPAC NameN-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide
SMILESCCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccncc1
InChIInChI=1S/C24H21F3N4O2/c1-3-19-22(30(2)23(32)17-10-12-28-13-11-17)31-14-4-5-20(21(31)29-19)33-15-16-6-8-18(9-7-16)24(25,26)27/h4-14H,3,15H2,1-2H3
InChIKeyIKJFCQSUXYLNRY-UHFFFAOYSA-N
XLogP5.17
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.45
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide 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-methylpyridine-4-carboxamide?
The IUPAC name of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide (CID 46948337) is N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide is CCc1nc2c(OCc3ccc(C(F)(F)F)cc3)cccn2c1N(C)C(=O)c1ccncc1.
What is the InChIKey of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide?
The InChIKey is IKJFCQSUXYLNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21F3N4O2/c1-3-19-22(30(2)23(32)17-10-12-28-13-11-17)31-14-4-5-20(21(31)29-19)33-15-16-6-8-18(9-7-16)24(25,26)27/h4-14H,3,15H2,1-2H3.
What are the key properties of N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide?
N-[2-ethyl-8-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylpyridine-4-carboxamide has a molecular weight of 454.45 g/mol, XLogP of 5.17, 6 rotatable bonds, 0 hydrogen bond donors, and 5 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-methylpyridine-4-carboxamide is sourced from PubChem (CID 46948337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).