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Chemical ID: 3959383
Chemical ID:
3959383
Name [?]:
N,N-diisopropyl-2-(tetrahydrofuran-2-ylmethylamino)propanamide
SMILES [?]:
CC(C)N(C(C)C)C(=O)C(C)NCC1CCCO1
InChi [?]:
InChI=1/C14H28N2O2/c1-10(2)16(11(3)4)14(17)12(5)15-9-13-7-6-8-18-13/h10-13,15H,6-9H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,3,6,7,11,16,15,17,13,2,5,10,14,8,12,4,9,18/E:(1,2,3,4)(10,11)/rA:18cCCCNCCCCOCCNCCCCCO/rB:s1;s2;s2;s4;s5;s5;s4;d8;s8;s10;s10;s12;s13;s14;s15;s16;s14s17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H28N2O2 |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 7.67602 |
Area: | 469.282 |
Solvation: | -4.05603 |
Coulombic: | -32.2628 |
Bond Count [?]
All: | 18 |
Single: | 17 |
Double: | 1 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 256.384 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 1.78 |
LogP (Chemaxon): | 1.25 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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