N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide

C23H18F3N3O — CID 122284533

IUPACN-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESCc1cccn2cc(-c3ccc(NC(=O)Cc4cccc(C(F)(F)F)c4)cc3)nc12
InChIInChI=1S/C23H18F3N3O/c1-15-4-3-11-29-14-20(28-22(15)29)17-7-9-19(10-8-17)27-21(30)13-16-5-2-6-18(12-16)23(24,25)26/h2-12,14H,13H2,1H3,(H,27,30)
InChIKeyJINLCSZRONUIEB-UHFFFAOYSA-N
MW409.41 g/mol
LogP5.51
Rot. Bonds4

About N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide

N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 122284533) has the molecular formula C23H18F3N3O and a molecular weight of 409.41 g/mol. Its IUPAC name is N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID122284533
Molecular FormulaC23H18F3N3O
Molecular Weight409.41 g/mol
Exact Mass409.14
IUPAC NameN-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESCc1cccn2cc(-c3ccc(NC(=O)Cc4cccc(C(F)(F)F)c4)cc3)nc12
InChIInChI=1S/C23H18F3N3O/c1-15-4-3-11-29-14-20(28-22(15)29)17-7-9-19(10-8-17)27-21(30)13-16-5-2-6-18(12-16)23(24,25)26/h2-12,14H,13H2,1H3,(H,27,30)
InChIKeyJINLCSZRONUIEB-UHFFFAOYSA-N
XLogP5.51
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.41
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide (CID 122284533) is N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide is Cc1cccn2cc(-c3ccc(NC(=O)Cc4cccc(C(F)(F)F)c4)cc3)nc12.
What is the InChIKey of N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is JINLCSZRONUIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F3N3O/c1-15-4-3-11-29-14-20(28-22(15)29)17-7-9-19(10-8-17)27-21(30)13-16-5-2-6-18(12-16)23(24,25)26/h2-12,14H,13H2,1H3,(H,27,30).
What are the key properties of N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 409.41 g/mol, XLogP of 5.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 122284533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).