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Chemical ID: 5820754
Chemical ID:
5820754
Name [?]:
N-[4-(carbamoylmethoxy)phenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)OCC(=O)N
InChi [?]:
InChI=1/C10H12N2O3/c1-7(13)12-8-2-4-9(5-3-8)15-6-10(11)14/h2-5H,6H2,1H3,(H2,11,14)(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,6,10,7,9,12,2,5,8,13,15,4,3,14,11/E:(2,3)(4,5)/rA:15nCCONCCCCCCOCCON/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;s12;d13;s13;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H12N2O3 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 4.83276 |
Area: | 393.036 |
Solvation: | -4.99313 |
Coulombic: | -50.4143 |
Bond Count [?]
All: | 15 |
Single: | 10 |
Double: | 5 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 208.214 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 5 |
XLogP: | -0.15 |
LogP (Chemaxon): | -0.2 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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