Chemical ID: 4253515

c1ccc(cc1)CC2CCNCC2
Chemical ID:
4253515
Name [?]:
4-benzylpiperidine
SMILES [?]:
c1ccc(cc1)CC2CCNCC2
InChi [?]:
InChI=1/C12H17N/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-5,12-13H,6-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,9,13,10,12,7,4,8,11/E:(2,3)(4,5)(6,7)(8,9)/rA:13nCCCCCCCCCCNCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.79141
Area:350.168
Solvation:-0.962792
Coulombic:-10.994
Bond Count [?]
All:14
Single:11
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:175.27
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.64
LogP (Chemaxon):2.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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