Chemical ID: 4345379

Cc1cccc(c1)OCC(=O)NCCCOC
Chemical ID:
4345379
Name [?]:
N-(3-methoxypropyl)-2-(3-methylphenoxy)-acetamide
SMILES [?]:
Cc1cccc(c1)OCC(=O)NCCCOC
InChi [?]:
InChI=1/C13H19NO3/c1-11-5-3-6-12(9-11)17-10-13(15)14-7-4-8-16-2/h3,5-6,9H,4,7-8,10H2,1-2H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,17,4,14,3,5,13,15,7,9,2,6,10,12,11,16,8/rA:17nCCCCCCCOCCONCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;s13;s14;s15;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.34983
Area:463.789
Solvation:-5.2449
Coulombic:-36.2123
Bond Count [?]
All:17
Single:13
Double:4
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:237.295
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.71
LogP (Chemaxon):1.07

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Descriptor Annotations

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