2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide

C16H17F3N4O2 — CID 128998562

IUPAC2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
SMILESO=C(Cn1ccccc1=O)NCC1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C16H17F3N4O2/c17-16(18,19)12-9-23-8-11(4-5-13(23)21-12)7-20-14(24)10-22-6-2-1-3-15(22)25/h1-3,6,9,11H,4-5,7-8,10H2,(H,20,24)
InChIKeyWRLPHERPVTYZIF-UHFFFAOYSA-N
MW354.33 g/mol
LogP1.44
Rot. Bonds4

About 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide

2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide (PubChem CID 128998562) has the molecular formula C16H17F3N4O2 and a molecular weight of 354.33 g/mol. Its IUPAC name is 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
PubChem CID128998562
Molecular FormulaC16H17F3N4O2
Molecular Weight354.33 g/mol
Exact Mass354.13
IUPAC Name2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
SMILESO=C(Cn1ccccc1=O)NCC1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C16H17F3N4O2/c17-16(18,19)12-9-23-8-11(4-5-13(23)21-12)7-20-14(24)10-22-6-2-1-3-15(22)25/h1-3,6,9,11H,4-5,7-8,10H2,(H,20,24)
InChIKeyWRLPHERPVTYZIF-UHFFFAOYSA-N
XLogP1.44
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(1-methylimidazol-2-yl)methyl]-N-(1-methyl-2-oxo-3-pyridinyl)piperidine-1-carboxamide
CID 71915884
3-{4-[2-(2-Cyclobutyl-5-methyl-1H-imidazol-1-YL)ethyl]piperidine-1-carbonyl}-6-methylpyridin-2-OL
CID 124077660
2-hydroxy-N,6-dimethyl-N-{[2-(trifluoromethyl)-5H,6H,7H,8H-imidazo[1,2-a]pyridin-6-yl]methyl}pyridine-4-carboxamide
CID 128971344
1-ethyl-3-[methyl({[2-(trifluoromethyl)-5H,6H,7H,8H-imidazo[1,2-a]pyridin-6-yl]methyl})amino]-1,2-dihydropyrazin-2-one
CID 128992860
(3R)-3-methyl-7-(4-methylimidazol-1-yl)-2-[2-oxo-2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]-3,4-dihydropyrido[1,2-a]pyrazine-1,6-dione
CID 90286672
3-Methyl-7-(4-methylimidazol-1-yl)-2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]-3,4-dihydropyrido[1,2-a]pyrazine-1,6-dione
CID 90300240
(3R)-3-methyl-7-(4-methylimidazol-1-yl)-2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]-3,4-dihydropyrido[1,2-a]pyrazine-1,6-dione
CID 118555666
1-[(Z)-2-methylbut-2-enyl]-5-(4-methylimidazol-1-yl)-6-oxo-N-[[6-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]pyridine-2-carboxamide
CID 138507672
3-methyl-8-(4-methylimidazol-1-yl)-2-[[6-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]-5H-pyrido[1,2-a][1,4]diazepine-1,7-dione
CID 146383833
1-{3-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl}prop-2-en-1-one
CID 122155868
1-[(3R)-3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one
CID 125537609
1-[(3S)-3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one
CID 125537610

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The IUPAC name of 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide (CID 128998562) is 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide.
What is the SMILES notation for 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The canonical SMILES for 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide is O=C(Cn1ccccc1=O)NCC1CCc2nc(C(F)(F)F)cn2C1.
What is the InChIKey of 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The InChIKey is WRLPHERPVTYZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F3N4O2/c17-16(18,19)12-9-23-8-11(4-5-13(23)21-12)7-20-14(24)10-22-6-2-1-3-15(22)25/h1-3,6,9,11H,4-5,7-8,10H2,(H,20,24).
What are the key properties of 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide has a molecular weight of 354.33 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1-pyridinyl)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide is sourced from PubChem (CID 128998562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).