Chemical ID: 5152455

CCCCC(=O)Nc1ccc(c(c1)NC(=O)CCCC)C
Chemical ID:
5152455
Name [?]:
N-(4-methyl-3-pentanoylamino-phenyl)pentanamide
SMILES [?]:
CCCCC(=O)Nc1ccc(c(c1)NC(=O)CCCC)C
InChi [?]:
InChI=1/C17H26N2O2/c1-4-6-8-16(20)18-14-11-10-13(3)15(12-14)19-17(21)9-7-5-2/h10-12H,4-9H2,1-3H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,20,21,2,19,3,18,4,17,10,9,13,11,8,12,5,15,7,14,6,16/rA:21nCCCCCONCCCCCCNCOCCCCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s12;s14;d15;s15;s17;s18;s19;s11;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H26N2O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.5574
Area:543.396
Solvation:-3.02755
Coulombic:-40.2291
Bond Count [?]
All:21
Single:16
Double:5
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:290.401
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.54
LogP (Chemaxon):3.36

Name Annotations

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Descriptor Annotations

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