N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide

C22H15ClF3N3O — CID 110208508

IUPACN-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cccc(-c3cn4cc(C(F)(F)F)cc(Cl)c4n3)c2)cc1
InChIInChI=1S/C22H15ClF3N3O/c1-13-5-7-14(8-6-13)21(30)27-17-4-2-3-15(9-17)19-12-29-11-16(22(24,25)26)10-18(23)20(29)28-19/h2-12H,1H3,(H,27,30)
InChIKeyGPIHGEFNYBGAHL-UHFFFAOYSA-N
MW429.83 g/mol
LogP6.23
Rot. Bonds3

About N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide

N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide (PubChem CID 110208508) has the molecular formula C22H15ClF3N3O and a molecular weight of 429.83 g/mol. Its IUPAC name is N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide
PubChem CID110208508
Molecular FormulaC22H15ClF3N3O
Molecular Weight429.83 g/mol
Exact Mass429.09
IUPAC NameN-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cccc(-c3cn4cc(C(F)(F)F)cc(Cl)c4n3)c2)cc1
InChIInChI=1S/C22H15ClF3N3O/c1-13-5-7-14(8-6-13)21(30)27-17-4-2-3-15(9-17)19-12-29-11-16(22(24,25)26)10-18(23)20(29)28-19/h2-12H,1H3,(H,27,30)
InChIKeyGPIHGEFNYBGAHL-UHFFFAOYSA-N
XLogP6.23
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.83
LogP ≤ 56.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121028698
2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 42658377
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-(trifluoromethoxy)benzamide
CID 122284288
2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 42737754
N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]thiophene-2-carboxamide
CID 42737759
4-tert-butyl-N-(3-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 40506192
N-[3-[5-(3,4-dichlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-4-(trifluoromethyl)benzamide
CID 83284360
4-methyl-N-[3-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]phenyl]benzamide
CID 27654804
4-chloro-N-[3-(6-methylquinolin-2-yl)phenyl]benzamide
CID 74763620
3,5-dimethyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121090021
N-[3-(8-anilinoimidazo[1,2-a]pyrazin-6-yl)phenyl]-4-tert-butylbenzamide
CID 11397050
8-chloro-N'-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbohydrazide
CID 110208477

Frequently Asked Questions

What is the IUPAC name of N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide?
The IUPAC name of N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide (CID 110208508) is N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide.
What is the SMILES notation for N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide?
The canonical SMILES for N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide is Cc1ccc(C(=O)Nc2cccc(-c3cn4cc(C(F)(F)F)cc(Cl)c4n3)c2)cc1.
What is the InChIKey of N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide?
The InChIKey is GPIHGEFNYBGAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClF3N3O/c1-13-5-7-14(8-6-13)21(30)27-17-4-2-3-15(9-17)19-12-29-11-16(22(24,25)26)10-18(23)20(29)28-19/h2-12H,1H3,(H,27,30).
What are the key properties of N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide?
N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide has a molecular weight of 429.83 g/mol, XLogP of 6.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]-4-methylbenzamide is sourced from PubChem (CID 110208508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).