Chemical ID: 3968309

CN(C)CCc1c[nH]c2c1c(ccc2)O
Chemical ID:
3968309
Name [?]:
3-(2-dimethylaminoethyl)-1H-indol-4-ol
SMILES [?]:
CN(C)CCc1c[nH]c2c1c(ccc2)O
InChi [?]:
InChI=1/C12H16N2O/c1-14(2)7-6-9-8-13-10-4-3-5-11(15)12(9)10/h3-5,8,13,15H,6-7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,13,14,12,5,4,7,6,9,11,10,8,2,15/E:(1,2)/rA:15nCNCCCCCNCCCCCCO/rB:s1;s2;s2;s4;s5;d6;s7;s8;s6s9;d10;s11;d12;d9s13;s11;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H16N2O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.2805
Area:382.415
Solvation:-2.27989
Coulombic:-32.2652
Bond Count [?]
All:16
Single:12
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:204.268
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.6
LogP (Chemaxon):1.51

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Descriptor Annotations

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