Chemical ID: 5492819

CC(C)C(C)NC(=O)COc1cccc(c1)NC(=O)C
Chemical ID:
5492819
Name [?]:
N-[3-(1,2-dimethylpropylcarbamoylmethoxy)phenyl]acetamide
SMILES [?]:
CC(C)C(C)NC(=O)COc1cccc(c1)NC(=O)C
InChi [?]:
InChI=1/C15H22N2O3/c1-10(2)11(3)16-15(19)9-20-14-7-5-6-13(8-14)17-12(4)18/h5-8,10-11H,9H2,1-4H3,(H,16,19)(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,3,5,20,13,14,12,16,9,2,4,18,15,11,7,6,17,19,8,10/E:(1,2)/rA:20cCCCCCNCOCOCCCCCCNCOC/rB:s1;s2;s2;s4;s4;s6;d7;s7;s9;s10;s11;d12;s13;d14;d11s15;s15;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22N2O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:7.82891
Area:504.746
Solvation:-4.78975
Coulombic:-47.5004
Bond Count [?]
All:20
Single:15
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:278.347
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.9
LogP (Chemaxon):1.67

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue