Chemical ID: 5562311

CCCNC(=O)C1CCN(CC1)Cc2c(ccs2)C
Chemical ID:
5562311
Name [?]:
1-[(3-methyl-2-thienyl)methyl]-N-propyl-piperidine-4-carboxamide
SMILES [?]:
CCCNC(=O)C1CCN(CC1)Cc2c(ccs2)C
InChi [?]:
InChI=1/C15H24N2OS/c1-3-7-16-15(18)13-4-8-17(9-5-13)11-14-12(2)6-10-19-14/h6,10,13H,3-5,7-9,11H2,1-2H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,19,2,8,12,16,3,9,11,17,13,15,7,14,5,4,10,6,18/E:(4,5)(8,9)/rA:19nCCCNCOCCCNCCCCCCCSC/rB:s1;s2;s3;s4;d5;s5;s7;s8;s9;s10;s7s11;s10;s13;d14;s15;d16;s14s17;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2OS
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:10.0149
Area:497.162
Solvation:-2.41415
Coulombic:-26.5328
Bond Count [?]
All:20
Single:17
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:280.43
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.47
LogP (Chemaxon):2.06

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Descriptor Annotations

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