ChemDB: Chemical Search
Download
Chemical ID: 6919512
Chemical ID:
6919512
Name [?]:
None
SMILES [?]:
C1CCN2CC3CC(C2C1)CN4C3C(CCC4)O
InChi [?]:
InChI=1/C15H26N2O/c18-14-5-3-7-17-9-11-8-12(15(14)17)10-16-6-2-1-4-13(11)16/h11-15,18H,1-10H2
InChi Info:
AuxInfo=1/0/N:1,2,16,10,15,3,17,7,11,5,8,6,9,14,13,4,12,18/rA:18cCCCNCCCCCCCNCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s1s9;s8;s11;s6s12;s13;s14;s15;s12s16;s14;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H26N2O |
All Atoms: | 44 |
Heavy Atoms: | 18 |
Chiral Atoms: | 7 |
ZAP Information [?]
Total: | 7.58137 |
Area: | 379.686 |
Solvation: | -1.91078 |
Coulombic: | -26.0871 |
Bond Count [?]
All: | 21 |
Single: | 21 |
Double: | 0 |
Rotors: | 0 |
Chiral: | 0 |
Rigid Segments: | 1 |
Chemical Properties
Molecular Weight: | 250.38 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 1.09 |
LogP (Chemaxon): | 0.98 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|