CID 150238

9-amino-n-[3-(dimethylamino)propyl]acridine-4-carboxamide

Structural Information

Molecular Formula
C19H22N4O
SMILES
CN(C)CCCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)N
InChI
InChI=1S/C19H22N4O/c1-23(2)12-6-11-21-19(24)15-9-5-8-14-17(20)13-7-3-4-10-16(13)22-18(14)15/h3-5,7-10H,6,11-12H2,1-2H3,(H2,20,22)(H,21,24)
InChIKey
VNWAULKXOPRJEL-UHFFFAOYSA-N
Compound name
9-amino-N-[3-(dimethylamino)propyl]acridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

112
References

2644
Patents

322.17935 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.18663 176.4
[M+Na]+ 345.16857 183.4
[M-H]- 321.17207 181.3
[M+NH4]+ 340.21317 191.0
[M+K]+ 361.14251 179.0
[M+H-H2O]+ 305.17661 167.1
[M+HCOO]- 367.17755 199.5
[M+CH3COO]- 381.19320 221.6
[M+Na-2H]- 343.15402 183.1
[M]+ 322.17880 178.6
[M]- 322.17990 178.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe