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Chemical ID: 6468908
Chemical ID:
6468908
Name [?]:
N-sec-butyl-N'-(tetrahydrofuran-2-ylmethyl)oxamide
SMILES [?]:
CCC(C)NC(=O)C(=O)NCC1CCCO1
InChi [?]:
InChI=1/C11H20N2O3/c1-3-8(2)13-11(15)10(14)12-7-9-5-4-6-16-9/h8-9H,3-7H2,1-2H3,(H,12,14)(H,13,15)
InChi Info:
AuxInfo=1/1/N:1,4,2,14,13,15,11,3,12,8,6,10,5,9,7,16/rA:16cCCCCNCOCONCCCCCO/rB:s1;s2;s3;s3;s5;d6;s6;d8;s8;s10;s11;s12;s13;s14;s12s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H20N2O3 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 8.18143 |
Area: | 440.354 |
Solvation: | -2.82743 |
Coulombic: | -54.8164 |
Bond Count [?]
All: | 16 |
Single: | 14 |
Double: | 2 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 228.288 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 0.49 |
LogP (Chemaxon): | -0.02 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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