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Chemical ID: 6379315
Chemical ID:
6379315
Name [?]:
N,N-diisobutylpentanamide
SMILES [?]:
CCCCC(=O)N(CC(C)C)CC(C)C
InChi [?]:
InChI=1/C13H27NO/c1-6-7-8-13(15)14(9-11(2)3)10-12(4)5/h11-12H,6-10H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,10,11,14,15,2,3,4,8,12,9,13,5,7,6/E:(2,3,4,5)(9,10)(11,12)/rA:15nCCCCCONCCCCCCCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;s9;s9;s7;s12;s13;s13;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H27NO |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.41621 |
Area: | 433.279 |
Solvation: | -1.41576 |
Coulombic: | -17.7751 |
Bond Count [?]
All: | 14 |
Single: | 13 |
Double: | 1 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 213.36 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 3.4 |
LogP (Chemaxon): | 3.31 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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