Chemical ID: 4386487

CC(C)c1ccccc1NC(=O)COC
Chemical ID:
4386487
Name [?]:
N-(2-isopropylphenyl)-2-methoxy-acetamide
SMILES [?]:
CC(C)c1ccccc1NC(=O)COC
InChi [?]:
InChI=1/C12H17NO2/c1-9(2)10-6-4-5-7-11(10)13-12(14)8-15-3/h4-7,9H,8H2,1-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,15,6,7,5,8,13,2,4,9,11,10,12,14/E:(1,2)/rA:15nCCCCCCCCCNCOCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:5.97494
Area:402.633
Solvation:-4.09088
Coulombic:-28.8908
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:207.269
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.95
LogP (Chemaxon):1.64

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Descriptor Annotations

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