2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide

C15H17F3N4O2 — CID 124890657

IUPAC2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1
InChIInChI=1S/C15H17F3N4O2/c1-8-13(24-9(2)20-8)14(23)19-5-10-3-4-12-21-11(15(16,17)18)7-22(12)6-10/h7,10H,3-6H2,1-2H3,(H,19,23)/t10-/m0/s1
InChIKeyYAPGMNUWUINZAH-JTQLQIEISA-N
MW342.32 g/mol
LogP2.50
Rot. Bonds3

About 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide

2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide (PubChem CID 124890657) has the molecular formula C15H17F3N4O2 and a molecular weight of 342.32 g/mol. Its IUPAC name is 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide
PubChem CID124890657
Molecular FormulaC15H17F3N4O2
Molecular Weight342.32 g/mol
Exact Mass342.13
IUPAC Name2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1
InChIInChI=1S/C15H17F3N4O2/c1-8-13(24-9(2)20-8)14(23)19-5-10-3-4-12-21-11(15(16,17)18)7-22(12)6-10/h7,10H,3-6H2,1-2H3,(H,19,23)/t10-/m0/s1
InChIKeyYAPGMNUWUINZAH-JTQLQIEISA-N
XLogP2.50
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide?
The IUPAC name of 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide (CID 124890657) is 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide is Cc1nc(C)c(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1.
What is the InChIKey of 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide?
The InChIKey is YAPGMNUWUINZAH-JTQLQIEISA-N. The full InChI is InChI=1S/C15H17F3N4O2/c1-8-13(24-9(2)20-8)14(23)19-5-10-3-4-12-21-11(15(16,17)18)7-22(12)6-10/h7,10H,3-6H2,1-2H3,(H,19,23)/t10-/m0/s1.
What are the key properties of 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide?
2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide has a molecular weight of 342.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 124890657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).