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

C15H17F3N4O2 — CID 128965016

IUPACN,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)N(C)CC1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C15H17F3N4O2/c1-9-13(19-8-24-9)14(23)21(2)5-10-3-4-12-20-11(15(16,17)18)7-22(12)6-10/h7-8,10H,3-6H2,1-2H3
InChIKeySPTAGBAYEDRZKS-UHFFFAOYSA-N
MW342.32 g/mol
LogP2.53
Rot. Bonds3

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

N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide (PubChem CID 128965016) has the molecular formula C15H17F3N4O2 and a molecular weight of 342.32 g/mol. Its IUPAC name is N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
PubChem CID128965016
Molecular FormulaC15H17F3N4O2
Molecular Weight342.32 g/mol
Exact Mass342.13
IUPAC NameN,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)N(C)CC1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C15H17F3N4O2/c1-9-13(19-8-24-9)14(23)21(2)5-10-3-4-12-20-11(15(16,17)18)7-22(12)6-10/h7-8,10H,3-6H2,1-2H3
InChIKeySPTAGBAYEDRZKS-UHFFFAOYSA-N
XLogP2.53
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.32
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide (CID 128965016) is N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide is Cc1ocnc1C(=O)N(C)CC1CCc2nc(C(F)(F)F)cn2C1.
What is the InChIKey of N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is SPTAGBAYEDRZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F3N4O2/c1-9-13(19-8-24-9)14(23)21(2)5-10-3-4-12-20-11(15(16,17)18)7-22(12)6-10/h7-8,10H,3-6H2,1-2H3.
What are the key properties of N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 342.32 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 128965016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).