Chemical ID: 4182919

Cc1cc(cc(c1)NCc2cccc(c2)OC)C
Chemical ID:
4182919
Name [?]:
N-[(3-methoxyphenyl)methyl]-3,5-dimethyl-aniline
SMILES [?]:
Cc1cc(cc(c1)NCc2cccc(c2)OC)C
InChi [?]:
InChI=1/C16H19NO/c1-12-7-13(2)9-15(8-12)17-11-14-5-4-6-16(10-14)18-3/h4-10,17H,11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,18,17,12,11,13,3,7,5,15,9,2,4,10,6,14,8,16/E:(1,2)(8,9)(12,13)/rA:18nCCCCCCCNCCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;d11;s12;d13;d10s14;s14;s16;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H19NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.82713
Area:455.295
Solvation:-2.55524
Coulombic:-20.8201
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:241.328
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.17
LogP (Chemaxon):4.08

Name Annotations

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Descriptor Annotations

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