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Chemical ID: 6322317
Chemical ID:
6322317
Name [?]:
N-(2-methoxyethyl)benzamide
SMILES [?]:
COCCNC(=O)c1ccccc1
InChi [?]:
InChI=1/C10H13NO2/c1-13-8-7-11-10(12)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,11,10,12,9,13,4,3,8,6,5,7,2/E:(3,4)(5,6)/rA:13nCOCCNCOCCCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H13NO2 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.19083 |
Area: | 369.992 |
Solvation: | -3.05897 |
Coulombic: | -30.7603 |
Bond Count [?]
All: | 13 |
Single: | 9 |
Double: | 4 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 179.216 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 1.24 |
LogP (Chemaxon): | 0.78 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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