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Chemical ID: 6661287
Chemical ID:
6661287
Name [?]:
N,N-diethyl-2-phenyl-propanamide
SMILES [?]:
CCN(CC)C(=O)C(C)c1ccccc1
InChi [?]:
InChI=1/C13H19NO/c1-4-14(5-2)13(15)11(3)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,5,9,2,4,13,12,14,11,15,8,10,6,3,7/E:(1,2)(4,5)(7,8)(9,10)/rA:15cCCNCCCOCCCCCCCC/rB:s1;s2;s3;s4;s3;d6;s6;s8;s8;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H19NO |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.05007 |
Area: | 396.931 |
Solvation: | -1.8732 |
Coulombic: | -17.9718 |
Bond Count [?]
All: | 15 |
Single: | 11 |
Double: | 4 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 205.296 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 2.44 |
LogP (Chemaxon): | 2.55 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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