Chemical ID: 3965515

CC(C)NCC(COc1ccc(cc1)CC(=O)N)O
Chemical ID:
3965515
Name [?]:
2-[4-(2-hydroxy-3-isopropylamino-propoxy)phenyl]acetamide
SMILES [?]:
CC(C)NCC(COc1ccc(cc1)CC(=O)N)O
InChi [?]:
InChI=1/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)
InChi Info:
AuxInfo=1/1/N:1,3,11,13,10,14,15,5,7,2,12,6,9,16,18,4,19,17,8/E:(1,2)(3,4)(5,6)/rA:19cCCCNCCCOCCCCCCCCONO/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s12;s15;d16;s16;s6;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H22N2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:6.5083
Area:498.011
Solvation:-5.94196
Coulombic:-56.3566
Bond Count [?]
All:19
Single:15
Double:4
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:266.336
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:0.46
LogP (Chemaxon):0.56

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