N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide

C22H15F4N3O — CID 42881697

IUPACN-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide
SMILESCc1ccc2nc(-c3ccccc3F)c(NC(=O)c3ccc(C(F)(F)F)cc3)n2c1
InChIInChI=1S/C22H15F4N3O/c1-13-6-11-18-27-19(16-4-2-3-5-17(16)23)20(29(18)12-13)28-21(30)14-7-9-15(10-8-14)22(24,25)26/h2-12H,1H3,(H,28,30)
InChIKeyKHOAYORVWKKKMQ-UHFFFAOYSA-N
MW413.37 g/mol
LogP5.72
Rot. Bonds3

About N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide

N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide (PubChem CID 42881697) has the molecular formula C22H15F4N3O and a molecular weight of 413.37 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide
PubChem CID42881697
Molecular FormulaC22H15F4N3O
Molecular Weight413.37 g/mol
Exact Mass413.12
IUPAC NameN-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide
SMILESCc1ccc2nc(-c3ccccc3F)c(NC(=O)c3ccc(C(F)(F)F)cc3)n2c1
InChIInChI=1S/C22H15F4N3O/c1-13-6-11-18-27-19(16-4-2-3-5-17(16)23)20(29(18)12-13)28-21(30)14-7-9-15(10-8-14)22(24,25)26/h2-12H,1H3,(H,28,30)
InChIKeyKHOAYORVWKKKMQ-UHFFFAOYSA-N
XLogP5.72
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.37
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]furan-2-carboxamide
CID 42694227
N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]cyclopentanecarboxamide
CID 42881695
6-methyl-N-propyl-2-[[4-(trifluoromethyl)benzoyl]amino]imidazo[1,2-a]pyridine-3-carboxamide
CID 155560743
4-bromo-N-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42694129
2,2-dimethyl-N-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 42881752
4-fluoro-N-[2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42694194
4-methyl-N-[6-methyl-2-(5-methylfuran-2-yl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42694621
N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide
CID 42693739
2,4-dichloro-N-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42881751
1-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-phenylurea
CID 42694871
3-methyl-N-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]butanamide
CID 42694564
N-[2-(3-chlorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-3-fluorobenzamide
CID 42694420

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide?
The IUPAC name of N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide (CID 42881697) is N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide is Cc1ccc2nc(-c3ccccc3F)c(NC(=O)c3ccc(C(F)(F)F)cc3)n2c1.
What is the InChIKey of N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide?
The InChIKey is KHOAYORVWKKKMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F4N3O/c1-13-6-11-18-27-19(16-4-2-3-5-17(16)23)20(29(18)12-13)28-21(30)14-7-9-15(10-8-14)22(24,25)26/h2-12H,1H3,(H,28,30).
What are the key properties of N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide?
N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide has a molecular weight of 413.37 g/mol, XLogP of 5.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 42881697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).