Chemical ID: 3885478

CC1CCN(CC1)CC(=O)Nc2ccccc2N
Chemical ID:
3885478
Name [?]:
N-(2-aminophenyl)-2-(4-methyl-1-piperidyl)-acetamide
SMILES [?]:
CC1CCN(CC1)CC(=O)Nc2ccccc2N
InChi [?]:
InChI=1/C14H21N3O/c1-11-6-8-17(9-7-11)10-14(18)16-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,13,3,7,4,6,8,2,17,12,9,18,11,5,10/E:(6,7)(8,9)/rA:18nCCCCNCCCCONCCCCCCN/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21N3O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.24672
Area:441.301
Solvation:-2.7858
Coulombic:-42.3403
Bond Count [?]
All:19
Single:15
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:247.336
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:1.36
LogP (Chemaxon):1.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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