Chemical ID: 7257602

CCCC(=O)Nc1ccc(cc1)Oc2cccc(c2)C
Chemical ID:
7257602
Name [?]:
N-[4-(3-methylphenoxy)phenyl]butanamide
SMILES [?]:
CCCC(=O)Nc1ccc(cc1)Oc2cccc(c2)C
InChi [?]:
InChI=1/C17H19NO2/c1-3-5-17(19)18-14-8-10-15(11-9-14)20-16-7-4-6-13(2)12-16/h4,6-12H,3,5H2,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,20,2,16,3,17,15,8,12,9,11,19,18,7,10,14,4,6,5,13/E:(8,9)(10,11)/rA:20nCCCCONCCCCCCOCCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s10;s13;s14;d15;s16;d17;d14s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19NO2
All Atoms:39
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.39995
Area:484.002
Solvation:-2.70009
Coulombic:-28.9837
Bond Count [?]
All:21
Single:14
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:269.338
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.02
LogP (Chemaxon):4.29

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