CID 486933

3-amino-5-ethyl-6-methyl-4-(1-naphthylmethyl)-1h-pyridin-2-one

Structural Information

Molecular Formula
C19H20N2O
SMILES
CCC1=C(NC(=O)C(=C1CC2=CC=CC3=CC=CC=C32)N)C
InChI
InChI=1S/C19H20N2O/c1-3-15-12(2)21-19(22)18(20)17(15)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-10H,3,11,20H2,1-2H3,(H,21,22)
InChIKey
MQJVGJITCHUDKV-UHFFFAOYSA-N
Compound name
3-amino-5-ethyl-6-methyl-4-(naphthalen-1-ylmethyl)-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.15756 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 170.7
[M+Na]+ 315.14678 180.1
[M-H]- 291.15028 175.8
[M+NH4]+ 310.19138 185.3
[M+K]+ 331.12072 173.0
[M+H-H2O]+ 275.15482 162.2
[M+HCOO]- 337.15576 191.0
[M+CH3COO]- 351.17141 181.8
[M+Na-2H]- 313.13223 174.5
[M]+ 292.15701 169.9
[M]- 292.15811 169.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.