Chemical ID: 4335823

Cc1ccc(cc1)CN2CCN(CC2)C(C)C
Chemical ID:
4335823
Name [?]:
1-isopropyl-4-(p-tolylmethyl)piperazine
SMILES [?]:
Cc1ccc(cc1)CN2CCN(CC2)C(C)C
InChi [?]:
InChI=1/C15H24N2/c1-13(2)17-10-8-16(9-11-17)12-15-6-4-14(3)5-7-15/h4-7,13H,8-12H2,1-3H3
InChi Info:
AuxInfo=1/0/N:16,17,1,3,7,4,6,10,14,11,13,8,15,2,5,9,12/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:17nCCCCCCCCNCCNCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;s12;s9s13;s12;s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.33472
Area:434.7
Solvation:-1.53277
Coulombic:-11.3409
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:232.365
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.74
LogP (Chemaxon):2.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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