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

C16H14F3N5O — CID 129002375

IUPAC5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCC2CCc3nc(C(F)(F)F)cn3C2)nc1
InChIInChI=1S/C16H14F3N5O/c17-16(18,19)13-9-24-8-11(2-4-14(24)23-13)7-22-15(25)12-3-1-10(5-20)6-21-12/h1,3,6,9,11H,2,4,7-8H2,(H,22,25)
InChIKeyQSYLPYWLRWSZGY-UHFFFAOYSA-N
MW349.32 g/mol
LogP2.16
Rot. Bonds3

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

5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide (PubChem CID 129002375) has the molecular formula C16H14F3N5O and a molecular weight of 349.32 g/mol. Its IUPAC name is 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide
PubChem CID129002375
Molecular FormulaC16H14F3N5O
Molecular Weight349.32 g/mol
Exact Mass349.12
IUPAC Name5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCC2CCc3nc(C(F)(F)F)cn3C2)nc1
InChIInChI=1S/C16H14F3N5O/c17-16(18,19)13-9-24-8-11(2-4-14(24)23-13)7-22-15(25)12-3-1-10(5-20)6-21-12/h1,3,6,9,11H,2,4,7-8H2,(H,22,25)
InChIKeyQSYLPYWLRWSZGY-UHFFFAOYSA-N
XLogP2.16
TPSA83.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.32
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide with MolForge

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Related Compounds

1-methyl-6-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridazine-3-carboxamide
CID 129330547
2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidine-5-carboxamide
CID 129329094
5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide
CID 63718941
2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide
CID 129332825
6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide
CID 129329620
2-(1-methylpyrazol-4-yl)-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
CID 124737660
2-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrrole-3-carboxamide
CID 129329247
N-ethyl-6-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methylamino]pyridazine-3-carboxamide
CID 128998420
2-(1H-pyrazol-5-yl)-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
CID 129342084
3,5-dimethyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129329002
1-pyridin-2-yl-3-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129005982
1-pyridin-2-yl-3-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129330660

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide (CID 129002375) is 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide is N#Cc1ccc(C(=O)NCC2CCc3nc(C(F)(F)F)cn3C2)nc1.
What is the InChIKey of 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide?
The InChIKey is QSYLPYWLRWSZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N5O/c17-16(18,19)13-9-24-8-11(2-4-14(24)23-13)7-22-15(25)12-3-1-10(5-20)6-21-12/h1,3,6,9,11H,2,4,7-8H2,(H,22,25).
What are the key properties of 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide?
5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide has a molecular weight of 349.32 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 129002375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).