Chemical ID: 7500325

CCCCCC(=O)Nc1ccccc1C(=O)NC(C)(C)C
Chemical ID:
7500325
Name [?]:
2-hexanoylamino-N-tert-butyl-benzamide
SMILES [?]:
CCCCCC(=O)Nc1ccccc1C(=O)NC(C)(C)C
InChi [?]:
InChI=1/C17H26N2O2/c1-5-6-7-12-15(20)18-14-11-9-8-10-13(14)16(21)19-17(2,3)4/h8-11H,5-7,12H2,1-4H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,19,20,21,2,3,4,12,11,13,10,5,14,9,6,15,18,8,17,7,16/E:(2,3,4)/rA:21nCCCCCCONCCCCCCCONCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s14;d15;s15;s17;s18;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H26N2O2
All Atoms:47
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:11.0351
Area:523.317
Solvation:-2.04781
Coulombic:-43.7204
Bond Count [?]
All:21
Single:16
Double:5
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:290.401
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.37
LogP (Chemaxon):3.57

Name Annotations

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Descriptor Annotations

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