Chemical ID: 5076370

COc1ccc2c(c1)c(c[nH]2)CCO
Chemical ID:
5076370
Name [?]:
2-(5-methoxy-1H-indol-3-yl)ethanol
SMILES [?]:
COc1ccc2c(c1)c(c[nH]2)CCO
InChi [?]:
InChI=1/C11H13NO2/c1-14-9-2-3-11-10(6-9)8(4-5-13)7-12-11/h2-3,6-7,12-13H,4-5H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,12,13,8,10,9,3,7,6,11,14,2/rA:14nCOCCCCCCCCNCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;d9;s6s10;s9;s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H13NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.77265
Area:367.874
Solvation:-3.42421
Coulombic:-34.5667
Bond Count [?]
All:15
Single:11
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:191.226
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.36
LogP (Chemaxon):1.91

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Descriptor Annotations

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