CID 165813571

4-(decahydro-2,7-naphthyridine-2-carbonyl)piperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C14H25N3O2
SMILES
C1CNCC2C1CCN(C2)C(=O)C3(CCNCC3)O
InChI
InChI=1S/C14H25N3O2/c18-13(14(19)3-6-15-7-4-14)17-8-2-11-1-5-16-9-12(11)10-17/h11-12,15-16,19H,1-10H2
InChIKey
PWLBEQQXICVZFU-UHFFFAOYSA-N
Compound name
3,4,4a,5,6,7,8,8a-octahydro-1H-2,7-naphthyridin-2-yl-(4-hydroxypiperidin-4-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.19467 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.20195 168.7
[M+Na]+ 290.18389 169.1
[M-H]- 266.18739 165.3
[M+NH4]+ 285.22849 180.7
[M+K]+ 306.15783 164.4
[M+H-H2O]+ 250.19193 159.4
[M+HCOO]- 312.19287 172.2
[M+CH3COO]- 326.20852 174.0
[M+Na-2H]- 288.16934 169.3
[M]+ 267.19412 153.4
[M]- 267.19522 153.4
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.