Chemical ID: 5721254

Cc1cccc(c1)NC(=O)c2ccc(cc2C)C
Chemical ID:
5721254
Name [?]:
2,4-dimethyl-N-(m-tolyl)benzamide
SMILES [?]:
Cc1cccc(c1)NC(=O)c2ccc(cc2C)C
InChi [?]:
InChI=1/C16H17NO/c1-11-5-4-6-14(10-11)17-16(18)15-8-7-12(2)9-13(15)3/h4-10H,1-3H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,18,17,4,3,5,13,12,15,7,2,14,16,6,11,9,8,10/rA:18nCCCCCCCNCOCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s14;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.25195
Area:434.502
Solvation:-1.6106
Coulombic:-23.4988
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:239.312
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.3
LogP (Chemaxon):4.5

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Descriptor Annotations

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