Chemical ID: 4160029

Cc1ccc(cc1NC(=O)C=C(C)C)Cl
Chemical ID:
4160029
Name [?]:
N-(5-chloro-2-methyl-phenyl)-3-methyl-but-2-enamide
SMILES [?]:
Cc1ccc(cc1NC(=O)C=C(C)C)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H14ClNO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.71589
Area:408.852
Solvation:-1.50542
Coulombic:-22.5119
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:223.698
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.0
LogP (Chemaxon):2.96

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