Chemical ID: 6333248

C1CCC(C1)CCC(=O)N2CCN(CC2)C3CCCC3
Chemical ID:
6333248
Name [?]:
3-cyclopentyl-1-(4-cyclopentylpiperazin-1-yl)-propan-1-one
SMILES [?]:
C1CCC(C1)CCC(=O)N2CCN(CC2)C3CCCC3
InChi [?]:
InChI=1/C17H30N2O/c20-17(10-9-15-5-1-2-6-15)19-13-11-18(12-14-19)16-7-3-4-8-16/h15-16H,1-14H2
InChi Info:
AuxInfo=1/0/N:1,2,18,19,5,3,17,20,6,7,12,14,11,15,4,16,8,13,10,9/E:(1,2)(3,4)(5,6)(7,8)(11,12)(13,14)/rA:20nCCCCCCCCONCCNCCCCCCC/rB:s1;s2;s3;s1s4;s4;s6;s7;d8;s8;s10;s11;s12;s13;s10s14;s13;s16;s17;s18;s16s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H30N2O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.3359
Area:494.852
Solvation:-2.03535
Coulombic:-21.574
Bond Count [?]
All:22
Single:21
Double:1
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:278.433
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.45
LogP (Chemaxon):2.49

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Descriptor Annotations

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