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Chemical ID: 6640822
Chemical ID:
6640822
Name [?]:
N-(2-acetylphenyl)naphthalene-1-carboxamide
SMILES [?]:
CC(=O)c1ccccc1NC(=O)c2cccc3c2cccc3
InChi [?]:
InChI=1/C19H15NO2/c1-13(21)15-9-4-5-12-18(15)20-19(22)17-11-6-8-14-7-2-3-10-16(14)17/h2-12H,1H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,21,20,6,7,15,22,16,5,19,14,8,2,17,4,18,13,9,11,10,3,12/rA:22nCCOCCCCCCNCOCCCCCCCCCC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s18;d19;s20;s17d21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H15NO2 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.29841 |
Area: | 473.958 |
Solvation: | -2.55055 |
Coulombic: | -31.8744 |
Bond Count [?]
All: | 24 |
Single: | 14 |
Double: | 10 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 289.328 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.53 |
LogP (Chemaxon): | 4.06 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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