Chemical ID: 4255204

Cc1ccccc1CNC(C)c2ccccc2
Chemical ID:
4255204
Name [?]:
N-(o-tolylmethyl)-1-phenyl-ethanamine
SMILES [?]:
Cc1ccccc1CNC(C)c2ccccc2
InChi [?]:
InChI=1/C16H19N/c1-13-8-6-7-11-16(13)12-17-14(2)15-9-4-3-5-10-15/h3-11,14,17H,12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,15,14,16,4,5,3,13,17,6,8,2,10,12,7,9/E:(4,5)(9,10)/rA:17cCCCCCCCCNCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s10;s12;d13;s14;d15;d12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H19N
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:9.54758
Area:434.483
Solvation:-1.31448
Coulombic:-12.407
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:225.329
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.21
LogP (Chemaxon):4.23

Name Annotations

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Descriptor Annotations

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