Chemical ID: 4956337

CC1CCCCN1CCCNC(=O)c2ccc(cc2)N
Chemical ID:
4956337
Name [?]:
4-amino-N-[3-(2-methyl-1-piperidyl)propyl]benzamide
SMILES [?]:
CC1CCCCN1CCCNC(=O)c2ccc(cc2)N
InChi [?]:
InChI=1/C16H25N3O/c1-13-5-2-3-11-19(13)12-4-10-18-16(20)14-6-8-15(17)9-7-14/h6-9,13H,2-5,10-12,17H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,4,5,9,3,15,19,16,18,10,6,8,2,14,17,12,20,11,7,13/E:(6,7)(8,9)/rA:20cCCCCCCNCCCNCOCCCCCCN/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;s9;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H25N3O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:10.2514
Area:499.836
Solvation:-2.24452
Coulombic:-43.9153
Bond Count [?]
All:21
Single:17
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:275.389
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.15
LogP (Chemaxon):1.33

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Descriptor Annotations

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