2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide

C15H15F3N4O2 — CID 129332825

IUPAC2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccc[nH]c1=O
InChIInChI=1S/C15H15F3N4O2/c16-15(17,18)11-8-22-7-9(3-4-12(22)21-11)6-20-14(24)10-2-1-5-19-13(10)23/h1-2,5,8-9H,3-4,6-7H2,(H,19,23)(H,20,24)/t9-/m1/s1
InChIKeyLJNOHGLMCNLULL-SECBINFHSA-N
MW340.31 g/mol
LogP1.58
Rot. Bonds3

About 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide

2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide (PubChem CID 129332825) has the molecular formula C15H15F3N4O2 and a molecular weight of 340.31 g/mol. Its IUPAC name is 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide
PubChem CID129332825
Molecular FormulaC15H15F3N4O2
Molecular Weight340.31 g/mol
Exact Mass340.11
IUPAC Name2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccc[nH]c1=O
InChIInChI=1S/C15H15F3N4O2/c16-15(17,18)11-8-22-7-9(3-4-12(22)21-11)6-20-14(24)10-2-1-5-19-13(10)23/h1-2,5,8-9H,3-4,6-7H2,(H,19,23)(H,20,24)/t9-/m1/s1
InChIKeyLJNOHGLMCNLULL-SECBINFHSA-N
XLogP1.58
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.31
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide (CID 129332825) is 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide is O=C(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccc[nH]c1=O.
What is the InChIKey of 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide?
The InChIKey is LJNOHGLMCNLULL-SECBINFHSA-N. The full InChI is InChI=1S/C15H15F3N4O2/c16-15(17,18)11-8-22-7-9(3-4-12(22)21-11)6-20-14(24)10-2-1-5-19-13(10)23/h1-2,5,8-9H,3-4,6-7H2,(H,19,23)(H,20,24)/t9-/m1/s1.
What are the key properties of 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide?
2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide has a molecular weight of 340.31 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 129332825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).