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

C17H19F3N4O2 — CID 128965067

IUPACN,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C17H19F3N4O2/c1-22-6-5-12(7-15(22)25)16(26)23(2)8-11-3-4-14-21-13(17(18,19)20)10-24(14)9-11/h5-7,10-11H,3-4,8-9H2,1-2H3
InChIKeyQVTHFLILNCKRSB-UHFFFAOYSA-N
MW368.36 g/mol
LogP1.94
Rot. Bonds3

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

N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide (PubChem CID 128965067) has the molecular formula C17H19F3N4O2 and a molecular weight of 368.36 g/mol. Its IUPAC name is N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide
PubChem CID128965067
Molecular FormulaC17H19F3N4O2
Molecular Weight368.36 g/mol
Exact Mass368.15
IUPAC NameN,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C17H19F3N4O2/c1-22-6-5-12(7-15(22)25)16(26)23(2)8-11-3-4-14-21-13(17(18,19)20)10-24(14)9-11/h5-7,10-11H,3-4,8-9H2,1-2H3
InChIKeyQVTHFLILNCKRSB-UHFFFAOYSA-N
XLogP1.94
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.36
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide?
The IUPAC name of N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide (CID 128965067) is N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide?
The canonical SMILES for N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide is CN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide?
The InChIKey is QVTHFLILNCKRSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3N4O2/c1-22-6-5-12(7-15(22)25)16(26)23(2)8-11-3-4-14-21-13(17(18,19)20)10-24(14)9-11/h5-7,10-11H,3-4,8-9H2,1-2H3.
What are the key properties of N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide?
N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide has a molecular weight of 368.36 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-2-oxo-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-4-carboxamide is sourced from PubChem (CID 128965067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).