Chemical ID: 4220709

CC(C)NC(=O)C(=O)NCc1ccc(cc1)Cl
Chemical ID:
4220709
Name [?]:
N'-[(4-chlorophenyl)methyl]-N-isopropyl-oxamide
SMILES [?]:
CC(C)NC(=O)C(=O)NCc1ccc(cc1)Cl
InChi [?]:
InChI=1/C12H15ClN2O2/c1-8(2)15-12(17)11(16)14-7-9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,3,12,16,13,15,10,2,11,14,7,5,17,9,4,8,6/E:(1,2)(3,4)(5,6)/rA:17nCCCNCOCONCCCCCCCCl/rB:s1;s2;s2;s4;d5;s5;d7;s7;s9;s10;s11;d12;s13;d14;d11s15;s14;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15ClN2O2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.99814
Area:466.994
Solvation:-1.67671
Coulombic:-48.7474
Bond Count [?]
All:17
Single:12
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:254.712
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.11
LogP (Chemaxon):1.57

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Descriptor Annotations

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