Chemical ID: 4335954

c1cnccc1C(=O)N2CCN(CC2)C3CCCCC3
Chemical ID:
4335954
Name [?]:
(4-cyclohexylpiperazin-1-yl)-(4-pyridyl)methanone
SMILES [?]:
c1cnccc1C(=O)N2CCN(CC2)C3CCCCC3
InChi [?]:
InChI=1/C16H23N3O/c20-16(14-6-8-17-9-7-14)19-12-10-18(11-13-19)15-4-2-1-3-5-15/h6-9,15H,1-5,10-13H2
InChi Info:
AuxInfo=1/0/N:18,17,19,16,20,1,5,2,4,11,13,10,14,6,15,7,3,12,9,8/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:20nCCNCCCCONCCNCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;s11;s12;s9s13;s12;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H23N3O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.98929
Area:462.38
Solvation:-2.57023
Coulombic:-26.6629
Bond Count [?]
All:22
Single:18
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:273.373
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.79
LogP (Chemaxon):1.27

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