3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole

C19H14F3N3O — CID 134807795

IUPAC3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
SMILESCc1noc(C)c1-c1cc(-c2ccccc2C(F)(F)F)cn2cncc12
InChIInChI=1S/C19H14F3N3O/c1-11-18(12(2)26-24-11)15-7-13(9-25-10-23-8-17(15)25)14-5-3-4-6-16(14)19(20,21)22/h3-10H,1-2H3
InChIKeyDWTSEHWWCMQDQM-UHFFFAOYSA-N
MW357.34 g/mol
LogP5.29
Rot. Bonds2

About 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole

3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole (PubChem CID 134807795) has the molecular formula C19H14F3N3O and a molecular weight of 357.34 g/mol. Its IUPAC name is 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole.

Molecular Properties

Compound Name3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
PubChem CID134807795
Molecular FormulaC19H14F3N3O
Molecular Weight357.34 g/mol
Exact Mass357.11
IUPAC Name3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
SMILESCc1noc(C)c1-c1cc(-c2ccccc2C(F)(F)F)cn2cncc12
InChIInChI=1S/C19H14F3N3O/c1-11-18(12(2)26-24-11)15-7-13(9-25-10-23-8-17(15)25)14-5-3-4-6-16(14)19(20,21)22/h3-10H,1-2H3
InChIKeyDWTSEHWWCMQDQM-UHFFFAOYSA-N
XLogP5.29
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.34
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-Tert-Butyl-2-[4-(3,5-Dimethyl-1,2-Oxazol-4-Yl)phenyl]imidazo[1,2-A]pyrazin-3-Amine
CID 86208116
2-[1-[2-[(5-Cyclopropyl-3-methyl-1,2-oxazol-4-yl)methyl]-4-fluorophenyl]-6-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
CID 71225451
2-[1-[2-[(5-Cyclopropyl-3-methyl-1,2-oxazol-4-yl)methyl]-4-(trifluoromethyl)phenyl]-6-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
CID 71225497
7-Ethyl-2-(3-phenyl-5-isoxazolyl)imidazo[1,2-a]pyridine
CID 2812530
6-Methyl-2-(3-phenyl-5-isoxazolyl)imidazo[1,2-a]pyridine
CID 2813808
3-[2,4-Bis(trifluoromethyl)phenyl]-5-[[2-(2-fluorophenyl)imidazo[4,5-c]pyridin-5-yl]methyl]-1,2-oxazole
CID 11670647
2-[8-[2-[(5-Cyclopropyl-3-methyl-1,2-oxazol-4-yl)methyl]-4-(trifluoromethyl)phenyl]-2-methylpyrrolo[1,2-a]pyrimidin-6-yl]acetic acid
CID 71225530
2-[1-[2-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-4-fluorophenyl]-6-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
CID 71225937
4-[[6-(3,5-Dimethyl-1,2-oxazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile
CID 71720056
N-isopropyl-2-(4-(3,5-dimethylisoxazol-4-yl)phenyl)imidazo[1,2-a]pyrazin-3-amine
CID 117834061
3-(Tert-butylamino)-2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117834596
N-cyclohexyl-2-[4-(3,5-dimethyl-4-isoxazolyl)phenyl]-imidazo[1,2-a]pyridin-3-amine
CID 117834606

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The IUPAC name of 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole (CID 134807795) is 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole.
What is the SMILES notation for 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The canonical SMILES for 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole is Cc1noc(C)c1-c1cc(-c2ccccc2C(F)(F)F)cn2cncc12.
What is the InChIKey of 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The InChIKey is DWTSEHWWCMQDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N3O/c1-11-18(12(2)26-24-11)15-7-13(9-25-10-23-8-17(15)25)14-5-3-4-6-16(14)19(20,21)22/h3-10H,1-2H3.
What are the key properties of 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole has a molecular weight of 357.34 g/mol, XLogP of 5.29, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-[6-[2-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole is sourced from PubChem (CID 134807795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).