Chemical ID: 5829652

CN(Cc1ccccc1)Cc2ccccc2F
Chemical ID:
5829652
Name [?]:
N-benzyl-N-[(2-fluorophenyl)methyl]methanamine
SMILES [?]:
CN(Cc1ccccc1)Cc2ccccc2F
InChi [?]:
InChI=1/C15H16FN/c1-17(11-13-7-3-2-4-8-13)12-14-9-5-6-10-15(14)16/h2-10H,11-12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,13,14,5,9,12,15,3,10,4,11,16,17,2/E:(3,4)(7,8)/rA:17cCNCCCCCCCCCCCCCCF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;s10;s11;d12;s13;d14;d11s15;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16FN
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:8.22677
Area:411.459
Solvation:-2.0597
Coulombic:-12.2088
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:229.293
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.64
LogP (Chemaxon):3.85

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Descriptor Annotations

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