Chemical ID: 4170750

Cc1ccc(cc1)NC(c2ccccc2)c3ccncc3
Chemical ID:
4170750
Name [?]:
4-methyl-N-[phenyl-(4-pyridyl)methyl]-aniline
SMILES [?]:
Cc1ccc(cc1)NC(c2ccccc2)c3ccncc3
InChi [?]:
InChI=1/C19H18N2/c1-15-7-9-18(10-8-15)21-19(16-5-3-2-4-6-16)17-11-13-20-14-12-17/h2-14,19,21H,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,11,15,3,7,4,6,17,21,18,20,2,10,16,5,9,19,8/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:21cCCCCCCCNCCCCCCCCCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s9;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:9.83766
Area:484.083
Solvation:-2.26442
Coulombic:-19.3935
Bond Count [?]
All:23
Single:14
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:274.36
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.14
LogP (Chemaxon):4.4

Name Annotations

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Descriptor Annotations

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