Chemical ID: 7520184

CCC(=O)c1ccc(cc1)OCCCNCCN(C)C
Chemical ID:
7520184
Name [?]:
1-[4-[3-(2-dimethylaminoethylamino)propoxy]phenyl]propan-1-one
SMILES [?]:
CCC(=O)c1ccc(cc1)OCCCNCCN(C)C
InChi [?]:
InChI=1/C16H26N2O2/c1-4-16(19)14-6-8-15(9-7-14)20-13-5-10-17-11-12-18(2)3/h6-9,17H,4-5,10-13H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,19,20,2,13,6,10,7,9,14,16,17,12,5,8,3,15,18,4,11/E:(2,3)(6,7)(8,9)/rA:20nCCCOCCCCCCOCCCNCCNCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s8;s11;s12;s13;s14;s15;s16;s17;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H26N2O2
All Atoms:46
Heavy Atoms:20
Chiral Atoms:None
ZAP Information [?]
Total:9.64202
Area:540.315
Solvation:-3.86584
Coulombic:-29.2949
Bond Count [?]
All:20
Single:16
Double:4
Rotors:10
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.86
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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