Chemical ID: 5047061

CCCC(=O)N(CCC(C)C)CCC(C)C
Chemical ID:
5047061
Name [?]:
N,N-diisopentylbutanamide
SMILES [?]:
CCCC(=O)N(CCC(C)C)CCC(C)C
InChi [?]:
InChI=1/C14H29NO/c1-6-7-14(16)15(10-8-12(2)3)11-9-13(4)5/h12-13H,6-11H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,10,11,15,16,2,3,8,13,7,12,9,14,4,6,5/E:(2,3,4,5)(8,9)(10,11)(12,13)/rA:16nCCCCONCCCCCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s9;s6;s12;s13;s14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H29NO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:10.3176
Area:472.885
Solvation:-1.50453
Coulombic:-18.0575
Bond Count [?]
All:15
Single:14
Double:1
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:227.386
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.39
LogP (Chemaxon):3.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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