6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide

C21H22F3N5O2 — CID 166009031

IUPAC6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NC2CCC(Nc3cccc4nc(C(F)(F)F)cn34)CC2)cn1
InChIInChI=1S/C21H22F3N5O2/c1-31-19-10-5-13(11-25-19)20(30)27-15-8-6-14(7-9-15)26-17-3-2-4-18-28-16(12-29(17)18)21(22,23)24/h2-5,10-12,14-15,26H,6-9H2,1H3,(H,27,30)
InChIKeyFHMARHNBXIJWFQ-UHFFFAOYSA-N
MW433.43 g/mol
LogP3.91
Rot. Bonds5

About 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide

6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide (PubChem CID 166009031) has the molecular formula C21H22F3N5O2 and a molecular weight of 433.43 g/mol. Its IUPAC name is 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide
PubChem CID166009031
Molecular FormulaC21H22F3N5O2
Molecular Weight433.43 g/mol
Exact Mass433.17
IUPAC Name6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NC2CCC(Nc3cccc4nc(C(F)(F)F)cn34)CC2)cn1
InChIInChI=1S/C21H22F3N5O2/c1-31-19-10-5-13(11-25-19)20(30)27-15-8-6-14(7-9-15)26-17-3-2-4-18-28-16(12-29(17)18)21(22,23)24/h2-5,10-12,14-15,26H,6-9H2,1H3,(H,27,30)
InChIKeyFHMARHNBXIJWFQ-UHFFFAOYSA-N
XLogP3.91
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.43
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-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 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide?
The IUPAC name of 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide (CID 166009031) is 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide?
The canonical SMILES for 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide is COc1ccc(C(=O)NC2CCC(Nc3cccc4nc(C(F)(F)F)cn34)CC2)cn1.
What is the InChIKey of 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide?
The InChIKey is FHMARHNBXIJWFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22F3N5O2/c1-31-19-10-5-13(11-25-19)20(30)27-15-8-6-14(7-9-15)26-17-3-2-4-18-28-16(12-29(17)18)21(22,23)24/h2-5,10-12,14-15,26H,6-9H2,1H3,(H,27,30).
What are the key properties of 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide?
6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide has a molecular weight of 433.43 g/mol, XLogP of 3.91, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]pyridine-3-carboxamide is sourced from PubChem (CID 166009031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).