Chemical ID: 6154215

c1ccc(cc1)CNCC2CCC2
Chemical ID:
6154215
Name [?]:
N-(cyclobutylmethyl)-1-phenyl-methanamine
SMILES [?]:
c1ccc(cc1)CNCC2CCC2
InChi [?]:
InChI=1/C12H17N/c1-2-5-11(6-3-1)9-13-10-12-7-4-8-12/h1-3,5-6,12-13H,4,7-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,3,5,11,13,7,9,4,10,8/E:(2,3)(5,6)(7,8)/rA:13nCCCCCCCNCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s10s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:8.33078
Area:374.654
Solvation:-1.03557
Coulombic:-11.3106
Bond Count [?]
All:14
Single:11
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:175.27
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.84
LogP (Chemaxon):2.68

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Descriptor Annotations

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