1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one

C14H10F3N3O — CID 38846572

IUPAC1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one
SMILESO=c1ccc(C(F)(F)F)cn1Cc1cn2ccccc2n1
InChIInChI=1S/C14H10F3N3O/c15-14(16,17)10-4-5-13(21)20(7-10)9-11-8-19-6-2-1-3-12(19)18-11/h1-8H,9H2
InChIKeyNCYNOUQHJQAFAQ-UHFFFAOYSA-N
MW293.25 g/mol
LogP2.56
Rot. Bonds2

About 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one

1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one (PubChem CID 38846572) has the molecular formula C14H10F3N3O and a molecular weight of 293.25 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one
PubChem CID38846572
Molecular FormulaC14H10F3N3O
Molecular Weight293.25 g/mol
Exact Mass293.08
IUPAC Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one
SMILESO=c1ccc(C(F)(F)F)cn1Cc1cn2ccccc2n1
InChIInChI=1S/C14H10F3N3O/c15-14(16,17)10-4-5-13(21)20(7-10)9-11-8-19-6-2-1-3-12(19)18-11/h1-8H,9H2
InChIKeyNCYNOUQHJQAFAQ-UHFFFAOYSA-N
XLogP2.56
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.25
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide
CID 38867518
7-chloro-2-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 51293693
2-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 18101780
1-[(3-methylquinoxalin-2-yl)methyl]-5-(trifluoromethyl)pyridin-2-one
CID 51142128
1-(2-bromoethyl)-5-(trifluoromethyl)pyridin-2-one
CID 63279616
2-[[3-(trifluoromethyl)phenoxy]methyl]imidazo[1,2-a]pyridine
CID 117255739
[1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazol-2-yl]methanamine
CID 62221773
1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-5-(trifluoromethyl)pyridin-2-one
CID 8012203
2-[(6-bromoindol-1-yl)methyl]imidazo[1,2-a]pyridine
CID 116621897
2-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 91831606
imidazo[1,2-a]pyridin-2-ylmethylazanium
CID 7012186
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpyrrole-3-carboxylic acid
CID 114189454

Frequently Asked Questions

What is the IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one?
The IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one (CID 38846572) is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one.
What is the SMILES notation for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one?
The canonical SMILES for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one is O=c1ccc(C(F)(F)F)cn1Cc1cn2ccccc2n1.
What is the InChIKey of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one?
The InChIKey is NCYNOUQHJQAFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3N3O/c15-14(16,17)10-4-5-13(21)20(7-10)9-11-8-19-6-2-1-3-12(19)18-11/h1-8H,9H2.
What are the key properties of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one?
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one has a molecular weight of 293.25 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one is sourced from PubChem (CID 38846572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).