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

C14H15F3N4O2 — CID 129341425

IUPAC5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C14H15F3N4O2/c1-8-12(19-7-23-8)13(22)18-4-9-2-3-11-20-10(14(15,16)17)6-21(11)5-9/h6-7,9H,2-5H2,1H3,(H,18,22)/t9-/m0/s1
InChIKeyYWGATOJDKGWFRA-VIFPVBQESA-N
MW328.29 g/mol
LogP2.19
Rot. Bonds3

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

5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide (PubChem CID 129341425) has the molecular formula C14H15F3N4O2 and a molecular weight of 328.29 g/mol. Its IUPAC name is 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
PubChem CID129341425
Molecular FormulaC14H15F3N4O2
Molecular Weight328.29 g/mol
Exact Mass328.11
IUPAC Name5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C14H15F3N4O2/c1-8-12(19-7-23-8)13(22)18-4-9-2-3-11-20-10(14(15,16)17)6-21(11)5-9/h6-7,9H,2-5H2,1H3,(H,18,22)/t9-/m0/s1
InChIKeyYWGATOJDKGWFRA-VIFPVBQESA-N
XLogP2.19
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide (CID 129341425) is 5-methyl-N-[[(6S)-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 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide is Cc1ocnc1C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1.
What is the InChIKey of 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is YWGATOJDKGWFRA-VIFPVBQESA-N. The full InChI is InChI=1S/C14H15F3N4O2/c1-8-12(19-7-23-8)13(22)18-4-9-2-3-11-20-10(14(15,16)17)6-21(11)5-9/h6-7,9H,2-5H2,1H3,(H,18,22)/t9-/m0/s1.
What are the key properties of 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide?
5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 328.29 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 129341425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).