Chemical ID: 6345124

CCCC(=O)NCC(C)C
Chemical ID:
6345124
Name [?]:
N-isobutylbutanamide
SMILES [?]:
CCCC(=O)NCC(C)C
InChi [?]:
InChI=1/C8H17NO/c1-4-5-8(10)9-6-7(2)3/h7H,4-6H2,1-3H3,(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,9,10,2,3,7,8,4,6,5/E:(2,3)/rA:10nCCCCONCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H17NO
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.98166
Area:337.332
Solvation:-1.45164
Coulombic:-21.2308
Bond Count [?]
All:9
Single:8
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:143.227
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.61
LogP (Chemaxon):1.45

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