5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide

C21H16F3N3O3S — CID 67436666

IUPAC5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide
SMILESCOc1ccc2ncc(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)n2c1
InChIInChI=1S/C21H16F3N3O3S/c1-29-13-6-7-18-26-9-15(27(18)10-13)17-8-16(19(31-17)20(25)28)30-11-12-4-2-3-5-14(12)21(22,23)24/h2-10H,11H2,1H3,(H2,25,28)
InChIKeyLPGAXDPCUCSQEL-UHFFFAOYSA-N
MW447.44 g/mol
LogP4.77
Rot. Bonds6

About 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide

5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide (PubChem CID 67436666) has the molecular formula C21H16F3N3O3S and a molecular weight of 447.44 g/mol. Its IUPAC name is 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide
PubChem CID67436666
Molecular FormulaC21H16F3N3O3S
Molecular Weight447.44 g/mol
Exact Mass447.09
IUPAC Name5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide
SMILESCOc1ccc2ncc(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)n2c1
InChIInChI=1S/C21H16F3N3O3S/c1-29-13-6-7-18-26-9-15(27(18)10-13)17-8-16(19(31-17)20(25)28)30-11-12-4-2-3-5-14(12)21(22,23)24/h2-10H,11H2,1H3,(H2,25,28)
InChIKeyLPGAXDPCUCSQEL-UHFFFAOYSA-N
XLogP4.77
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.44
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 15983966
CID 15983966
CID 10253033
CID 10253033
CID 10409707
CID 10409707
CID 16050921
CID 16050921
CID 16050925
CID 16050925
CID 25263075
CID 25263075
CID 49862010
CID 49862010
CID 49862054
CID 49862054
CID 49862590
CID 49862590
CID 49862645
CID 49862645
CID 49862785
CID 49862785
CID 25263090
CID 25263090

Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide?
The IUPAC name of 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide (CID 67436666) is 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide.
What is the SMILES notation for 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide?
The canonical SMILES for 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide is COc1ccc2ncc(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)n2c1.
What is the InChIKey of 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide?
The InChIKey is LPGAXDPCUCSQEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3N3O3S/c1-29-13-6-7-18-26-9-15(27(18)10-13)17-8-16(19(31-17)20(25)28)30-11-12-4-2-3-5-14(12)21(22,23)24/h2-10H,11H2,1H3,(H2,25,28).
What are the key properties of 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide?
5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide has a molecular weight of 447.44 g/mol, XLogP of 4.77, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide is sourced from PubChem (CID 67436666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).