Chemical ID: 4164614

C(=CC(=O)N)C(=O)N
Chemical ID:
4164614
Name [?]:
but-2-enediamide
SMILES [?]:
C(=CC(=O)N)C(=O)N
InChi [?]:
InChI=1/C4H6N2O2/c5-3(7)1-2-4(6)8/h1-2H,(H2,5,7)(H2,6,8)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,8,5,7,4/E:(1,2)(3,4)(5,6)(7,8)/gE:(1,2)/rA:8nCCCONCON/rB:w1;s2;d3;s3;s1;d6;s6;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C4H6N2O2
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:2.74948
Area:256.677
Solvation:-3.66746
Coulombic:-48.0499
Bond Count [?]
All:7
Single:4
Double:3
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:114.103
H-Bond Donors:4
H-Bond Acceptors:4
XLogP:-1.87
LogP (Chemaxon):-1.69

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