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Chemical ID: 4261100
Chemical ID:
4261100
Name [?]:
N-(1-propylcyclopentyl)hexanamide
SMILES [?]:
CCCCCC(=O)NC1(CCCC1)CCC
InChi [?]:
InChI=1/C14H27NO/c1-3-5-6-9-13(16)15-14(10-4-2)11-7-8-12-14/h3-12H2,1-2H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,16,2,15,3,4,11,12,5,14,10,13,6,9,8,7/E:(7,8)(11,12)/rA:16nCCCCCCONCCCCCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s9s12;s9;s14;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H27NO |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.93106 |
Area: | 450.703 |
Solvation: | -1.3365 |
Coulombic: | -22.3597 |
Bond Count [?]
All: | 16 |
Single: | 15 |
Double: | 1 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 225.37 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 4.27 |
LogP (Chemaxon): | 3.16 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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