Chemical ID: 6919944

CCC12CCN(C(C1C)C(=O)c3c2cc(cc3)O)CC4CC4
Chemical ID:
6919944
Name [?]:
None
SMILES [?]:
CCC12CCN(C(C1C)C(=O)c3c2cc(cc3)O)CC4CC4
InChi [?]:
InChI=1/C19H25NO2/c1-3-19-8-9-20(11-13-4-5-13)17(12(19)2)18(22)15-7-6-14(21)10-16(15)19/h6-7,10,12-13,17,21H,3-5,8-9,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,9,2,21,22,16,17,4,5,14,19,8,20,15,12,13,7,10,3,6,18,11/E:(4,5)/rA:22cCCCCCNCCCCOCCCCCCOCCCC/rB:s1;s2;s3;s4;s5;s6;s3s7;s8;s7;d10;s10;s3s12;d13;s14;d15;d12s16;s15;s6;s19;s20;s20s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H25NO2
All Atoms:47
Heavy Atoms:22
Chiral Atoms:4
ZAP Information [?]
Total:9.4074
Area:475.053
Solvation:-2.46894
Coulombic:-31.6704
Bond Count [?]
All:25
Single:21
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:299.407
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.32
LogP (Chemaxon):3.16

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Descriptor Annotations

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