Chemical ID: 4685786

Cc1ccc(cc1)N2CC(N3C2c4ccccc4C3=O)C
Chemical ID:
4685786
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)N2CC(N3C2c4ccccc4C3=O)C
InChi [?]:
InChI=1/C18H18N2O/c1-12-7-9-14(10-8-12)19-11-13(2)20-17(19)15-5-3-4-6-16(15)18(20)21/h3-10,13,17H,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,21,15,16,14,17,3,7,4,6,9,2,10,5,13,18,12,19,8,11,20/E:(7,8)(9,10)/rA:21cCCCCCCCNCCNCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s8s11;s12;s13;d14;s15;d16;d13s17;s11s18;d19;s10;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:3
ZAP Information [?]
Total:8.69593
Area:431.879
Solvation:-2.10104
Coulombic:-26.2325
Bond Count [?]
All:24
Single:17
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:278.348
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.2
LogP (Chemaxon):4.09

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