Chemical ID: 6603378

CC(C(=O)N(C)C)NC(=O)c1ccc(cc1)C(C)(C)C
Chemical ID:
6603378
Name [?]:
N-[1-(dimethylcarbamoyl)ethyl]-4-tert-butyl-benzamide
SMILES [?]:
CC(C(=O)N(C)C)NC(=O)c1ccc(cc1)C(C)(C)C
InChi [?]:
InChI=1/C16H24N2O2/c1-11(15(20)18(5)6)17-14(19)12-7-9-13(10-8-12)16(2,3)4/h7-11H,1-6H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,18,19,20,6,7,12,16,13,15,2,11,14,9,3,17,8,5,10,4/E:(2,3,4)(5,6)(7,8)(9,10)/rA:20cCCCONCCNCOCCCCCCCCCC/rB:s1;s2;d3;s3;s5;s5;s2;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s17;s17;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H24N2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:10.1855
Area:498.026
Solvation:-2.2651
Coulombic:-40.5439
Bond Count [?]
All:20
Single:15
Double:5
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:276.374
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.08
LogP (Chemaxon):2.28

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