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Chemical ID: 4088337
Chemical ID:
4088337
Name [?]:
None
SMILES [?]:
C1CCN2CC3CC(C2C1)CN4C3CCCC4=O
InChi [?]:
InChI=1/C15H24N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h11-14H,1-10H2
InChi Info:
AuxInfo=1/0/N:1,2,15,10,14,16,3,7,5,11,6,8,9,13,17,4,12,18/rA:18cCCCNCCCCCCCNCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s1s9;s8;s11;s6s12;s13;s14;s15;s12s16;d17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H24N2O |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 5 |
ZAP Information [?]
Total: | 7.70497 |
Area: | 386.531 |
Solvation: | -1.95831 |
Coulombic: | -20.2448 |
Bond Count [?]
All: | 21 |
Single: | 20 |
Double: | 1 |
Rotors: | 0 |
Chiral: | 0 |
Rigid Segments: | 1 |
Chemical Properties
Molecular Weight: | 248.364 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | 1.38 |
LogP (Chemaxon): | 0.87 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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