Chemical ID: 6935610

CCC(C)(C)C(=O)Nc1ccccc1OCC
Chemical ID:
6935610
Name [?]:
N-(2-ethoxyphenyl)-2,2-dimethyl-butanamide
SMILES [?]:
CCC(C)(C)C(=O)Nc1ccccc1OCC
InChi [?]:
InChI=1/C14H21NO2/c1-5-14(3,4)13(16)15-11-9-7-8-10-12(11)17-6-2/h7-10H,5-6H2,1-4H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,17,4,5,2,16,11,12,10,13,9,14,6,3,8,7,15/E:(3,4)/rA:17nCCCCCCONCCCCCCOCC/rB:s1;s2;s3;s3;s3;d6;s6;s8;s9;d10;s11;d12;d9s13;s14;s15;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO2
All Atoms:38
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.37472
Area:436.002
Solvation:-2.52532
Coulombic:-30.0118
Bond Count [?]
All:17
Single:13
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:235.322
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.93
LogP (Chemaxon):3.71

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Descriptor Annotations

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