2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide

C22H17F3N4O — CID 20916126

IUPAC2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCc1nc2cccnc2n1-c1ccc(CC(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C22H17F3N4O/c1-14-27-19-7-4-12-26-21(19)29(14)16-10-8-15(9-11-16)13-20(30)28-18-6-3-2-5-17(18)22(23,24)25/h2-12H,13H2,1H3,(H,28,30)
InChIKeyZDBRIDGPUZAGMN-UHFFFAOYSA-N
MW410.40 g/mol
LogP4.93
Rot. Bonds4

About 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide

2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 20916126) has the molecular formula C22H17F3N4O and a molecular weight of 410.40 g/mol. Its IUPAC name is 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID20916126
Molecular FormulaC22H17F3N4O
Molecular Weight410.40 g/mol
Exact Mass410.14
IUPAC Name2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCc1nc2cccnc2n1-c1ccc(CC(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C22H17F3N4O/c1-14-27-19-7-4-12-26-21(19)29(14)16-10-8-15(9-11-16)13-20(30)28-18-6-3-2-5-17(18)22(23,24)25/h2-12H,13H2,1H3,(H,28,30)
InChIKeyZDBRIDGPUZAGMN-UHFFFAOYSA-N
XLogP4.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.40
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propylacetamide
CID 20916146
2-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 668862
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110696997
2-(4-phenylphenyl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26087747
3-(4-fluorophenyl)-2-methylimidazo[4,5-b]pyridine
CID 14119097
2-(2-methyl-1,3-benzoxazol-5-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110773886
3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 46277233
2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide
CID 20916212
N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide
CID 20916237
2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 46343993
1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]ethanone
CID 20916164
N-[2-(trifluoromethyl)phenyl]-2-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]imidazo[4,5-b]pyridin-3-yl]acetamide
CID 20908717

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide (CID 20916126) is 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide is Cc1nc2cccnc2n1-c1ccc(CC(=O)Nc2ccccc2C(F)(F)F)cc1.
What is the InChIKey of 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is ZDBRIDGPUZAGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N4O/c1-14-27-19-7-4-12-26-21(19)29(14)16-10-8-15(9-11-16)13-20(30)28-18-6-3-2-5-17(18)22(23,24)25/h2-12H,13H2,1H3,(H,28,30).
What are the key properties of 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide?
2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 410.40 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 20916126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).