Chemical ID: 5531477

c1cnccc1CN2CCN(CC2)C3CCCC3
Chemical ID:
5531477
Name [?]:
1-cyclopentyl-4-(4-pyridylmethyl)piperazine
SMILES [?]:
c1cnccc1CN2CCN(CC2)C3CCCC3
InChi [?]:
InChI=1/C15H23N3/c1-2-4-15(3-1)18-11-9-17(10-12-18)13-14-5-7-16-8-6-14/h5-8,15H,1-4,9-13H2
InChi Info:
AuxInfo=1/0/N:16,17,15,18,1,5,2,4,9,13,10,12,7,6,14,3,8,11/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)/rA:18nCCNCCCCNCCNCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s10;s11;s8s12;s11;s14;s15;s16;s14s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H23N3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.83732
Area:440.004
Solvation:-2.16279
Coulombic:-14.629
Bond Count [?]
All:20
Single:17
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:245.363
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.42
LogP (Chemaxon):1.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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