Chemical ID: 6355212

CCCCCCCCNC(=O)c1ccc(cc1)C
Chemical ID:
6355212
Name [?]:
4-methyl-N-octyl-benzamide
SMILES [?]:
CCCCCCCCNC(=O)c1ccc(cc1)C
InChi [?]:
InChI=1/C16H25NO/c1-3-4-5-6-7-8-13-17-16(18)15-11-9-14(2)10-12-15/h9-12H,3-8,13H2,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,18,2,3,4,5,6,7,14,16,13,17,8,15,12,10,9,11/E:(9,10)(11,12)/rA:18nCCCCCCCCNCOCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H25NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:11.3089
Area:510.61
Solvation:-1.45635
Coulombic:-25.1594
Bond Count [?]
All:18
Single:14
Double:4
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:247.376
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.49
LogP (Chemaxon):4.2

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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