Chemical ID: 4183116

Cc1ccc(cc1C)NCc2ccc(c(c2)C)OC
Chemical ID:
4183116
Name [?]:
N-[(4-methoxy-3-methyl-phenyl)methyl]-3,4-dimethyl-aniline
SMILES [?]:
Cc1ccc(cc1C)NCc2ccc(c(c2)C)OC
InChi [?]:
InChI=1/C17H21NO/c1-12-5-7-16(10-13(12)2)18-11-15-6-8-17(19-4)14(3)9-15/h5-10,18H,11H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,8,17,19,3,12,4,13,16,6,10,2,7,15,11,5,14,9,18/rA:19nCCCCCCCCNCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;s11;d12;s13;d14;d11s15;s15;s14;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H21NO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.37287
Area:476.173
Solvation:-2.53145
Coulombic:-20.6878
Bond Count [?]
All:20
Single:14
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.355
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.39
LogP (Chemaxon):4.55

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Descriptor Annotations

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