Chemical ID: 5057811

CC(CCN(C)C)Nc1cc(cc2c1nccc2)O
Chemical ID:
5057811
Name [?]:
8-(3-dimethylamino-1-methyl-propyl)aminoquinolin-6-ol
SMILES [?]:
CC(CCN(C)C)Nc1cc(cc2c1nccc2)O
InChi [?]:
InChI=1/C15H21N3O/c1-11(6-8-18(2)3)17-14-10-13(19)9-12-5-4-7-16-15(12)14/h4-5,7,9-11,17,19H,6,8H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,6,7,17,18,3,16,4,12,10,2,13,11,9,14,15,8,5,19/E:(2,3)/rA:19cCCCCNCCNCCCCCCNCCCO/rB:s1;s2;s3;s4;s5;s5;s2;s8;s9;d10;s11;d12;d9s13;s14;d15;s16;s13d17;s11;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21N3O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:8.92001
Area:469.029
Solvation:-2.80571
Coulombic:-37.9302
Bond Count [?]
All:20
Single:15
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.347
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.04
LogP (Chemaxon):0.92

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