Chemical ID: 3638722

c1cc(c(cc1N)Cl)NC(=O)CN2CCCCC2
Chemical ID:
3638722
Name [?]:
N-(4-amino-2-chloro-phenyl)-2-(1-piperidyl)acetamide
SMILES [?]:
c1cc(c(cc1N)Cl)NC(=O)CN2CCCCC2
InChi [?]:
InChI=1/C13H18ClN3O/c14-11-8-10(15)4-5-12(11)16-13(18)9-17-6-2-1-3-7-17/h4-5,8H,1-3,6-7,9,15H2,(H,16,18)
InChi Info:
AuxInfo=1/1/N:16,15,17,1,2,14,18,5,12,6,4,3,10,8,7,9,13,11/E:(2,3)(6,7)/rA:18nCCCCCCNClNCOCNCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18ClN3O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.83886
Area:453.188
Solvation:-2.49083
Coulombic:-42.0928
Bond Count [?]
All:19
Single:15
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:267.754
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:1.05
LogP (Chemaxon):1.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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