Chemical ID: 7105452

Cc1ccc(cc1)CNC2CCCCCC2
Chemical ID:
7105452
Name [?]:
N-(p-tolylmethyl)cycloheptanamine
SMILES [?]:
Cc1ccc(cc1)CNC2CCCCCC2
InChi [?]:
InChI=1/C15H23N/c1-13-8-10-14(11-9-13)12-16-15-6-4-2-3-5-7-15/h8-11,15-16H,2-7,12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,14,12,15,11,16,3,7,4,6,8,2,5,10,9/E:(2,3)(4,5)(6,7)(8,9)(10,11)/rA:16nCCCCCCCCNCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;s12;s13;s14;s10s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H23N
All Atoms:39
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.49949
Area:420.359
Solvation:-1.00949
Coulombic:-11.603
Bond Count [?]
All:17
Single:14
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:217.35
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.37
LogP (Chemaxon):4.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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