Chemical ID: 6155220

CCOCC(=O)N(Cc1ccccc1)C(C)C
Chemical ID:
6155220
Name [?]:
N-benzyl-2-ethoxy-N-isopropyl-acetamide
SMILES [?]:
CCOCC(=O)N(Cc1ccccc1)C(C)C
InChi [?]:
InChI=1/C14H21NO2/c1-4-17-11-14(16)15(12(2)3)10-13-8-6-5-7-9-13/h5-9,12H,4,10-11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,16,17,2,12,11,13,10,14,8,4,15,9,5,7,6,3/E:(2,3)(6,7)(8,9)/rA:17nCCOCCONCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;s9;d10;s11;d12;d9s13;s7;s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.94653
Area:436.183
Solvation:-3.95804
Coulombic:-25.6112
Bond Count [?]
All:17
Single:13
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:235.322
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.35
LogP (Chemaxon):2.06

Name Annotations

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Descriptor Annotations

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