Chemical ID: 4095516

Cc1cccc(c1)C(=O)Nc2ccc(cc2)N
Chemical ID:
4095516
Name [?]:
N-(4-aminophenyl)-3-methyl-benzamide
SMILES [?]:
Cc1cccc(c1)C(=O)Nc2ccc(cc2)N
InChi [?]:
InChI=1/C14H14N2O/c1-10-3-2-4-11(9-10)14(17)16-13-7-5-12(15)6-8-13/h2-9H,15H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,4,3,5,13,15,12,16,7,2,6,14,11,8,17,10,9/E:(5,6)(7,8)/rA:17nCCCCCCCCONCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14N2O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.49847
Area:418.847
Solvation:-1.9727
Coulombic:-39.1331
Bond Count [?]
All:18
Single:11
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:226.274
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.19
LogP (Chemaxon):2.79

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Descriptor Annotations

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