Chemical ID: 3994952

Cc1ccccc1NC(=O)CC(=NO)N
Chemical ID:
3994952
Name [?]:
3-amino-3-hydroxyimino-N-(o-tolyl)propanamide
SMILES [?]:
Cc1ccccc1NC(=O)CC(=NO)N
InChi [?]:
InChI=1/C10H13N3O2/c1-7-4-2-3-5-8(7)12-10(14)6-9(11)13-15/h2-5,15H,6H2,1H3,(H2,11,13)(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,4,5,3,6,11,2,7,12,9,15,8,13,10,14/rA:15nCCCCCCCNCOCCNON/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;w12;s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H13N3O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.63045
Area:390.247
Solvation:-3.12571
Coulombic:-48.7581
Bond Count [?]
All:15
Single:10
Double:5
Rotors:4
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:207.229
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:0.54
LogP (Chemaxon):0.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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