Chemical ID: 3904917

COc1ccc(cc1NC(=O)CN2CCCCC2)N
Chemical ID:
3904917
Name [?]:
N-(5-amino-2-methoxy-phenyl)-2-(1-piperidyl)acetamide
SMILES [?]:
COc1ccc(cc1NC(=O)CN2CCCCC2)N
InChi [?]:
InChI=1/C14H21N3O2/c1-19-13-6-5-11(15)9-12(13)16-14(18)10-17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10,15H2,1H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,5,4,14,18,7,12,6,8,3,10,19,9,13,11,2/E:(3,4)(7,8)/rA:19nCOCCCCCCNCOCNCCCCCN/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;s6;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21N3O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.68841
Area:456.804
Solvation:-3.73168
Coulombic:-48.7607
Bond Count [?]
All:20
Single:16
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:263.336
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:0.76
LogP (Chemaxon):0.92

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Descriptor Annotations

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