Chemical ID: 6527180

COc1ccccc1C(=O)NC(CO)CO
Chemical ID:
6527180
Name [?]:
N-[2-hydroxy-1-(hydroxymethyl)ethyl]-2-methoxy-benzamide
SMILES [?]:
COc1ccccc1C(=O)NC(CO)CO
InChi [?]:
InChI=1/C11H15NO4/c1-16-10-5-3-2-4-9(10)11(15)12-8(6-13)7-14/h2-5,8,13-14H,6-7H2,1H3,(H,12,15)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,13,15,12,8,3,9,11,14,16,10,2/E:(6,7)(13,14)/rA:16nCOCCCCCCCONCCOCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s9;s11;s12;s13;s12;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15NO4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:3.9657
Area:402.099
Solvation:-6.08677
Coulombic:-59.9024
Bond Count [?]
All:16
Single:12
Double:4
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:225.241
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:-0.04
LogP (Chemaxon):-0.12

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Descriptor Annotations

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