Chemical ID: 5509238

CCNC(=O)C(C)Oc1ccc(cc1)C
Chemical ID:
5509238
Name [?]:
N-ethyl-2-(4-methylphenoxy)-propanamide
SMILES [?]:
CCNC(=O)C(C)Oc1ccc(cc1)C
InChi [?]:
InChI=1/C12H17NO2/c1-4-13-12(14)10(3)15-11-7-5-9(2)6-8-11/h5-8,10H,4H2,1-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,15,7,2,11,13,10,14,12,6,9,4,3,5,8/E:(5,6)(7,8)/rA:15cCCNCOCCOCCCCCCC/rB:s1;s2;s3;d4;s4;s6;s6;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.03414
Area:410.621
Solvation:-3.23139
Coulombic:-29.8987
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:207.269
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.5
LogP (Chemaxon):2.06

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Descriptor Annotations

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