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Chemical ID: 6291575
Chemical ID:
6291575
Name [?]:
2-amino-5-methyl-N-(p-tolyl)benzamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)c2cc(ccc2N)C
InChi [?]:
InChI=1/C15H16N2O/c1-10-3-6-12(7-4-10)17-15(18)13-9-11(2)5-8-14(13)16/h3-9H,16H2,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,18,3,7,14,4,6,15,12,2,13,5,11,16,9,17,8,10/E:(3,4)(6,7)/rA:18nCCCCCCCNCOCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s13;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16N2O |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.93512 |
Area: | 433.884 |
Solvation: | -1.91197 |
Coulombic: | -39.3012 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 7 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 240.3 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 3 |
XLogP: | 3.48 |
LogP (Chemaxon): | 3.9 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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