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Chemical ID: 5207420
Chemical ID:
5207420
Name [?]:
N-(1-methyl-2-phenyl-ethyl)-1-phenyl-propan-2-amine
SMILES [?]:
CC(Cc1ccccc1)NC(C)Cc2ccccc2
InChi [?]:
InChI=1/C18H23N/c1-15(13-17-9-5-3-6-10-17)19-16(2)14-18-11-7-4-8-12-18/h3-12,15-16,19H,13-14H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,12,7,17,6,8,16,18,5,9,15,19,3,13,2,11,4,14,10/E:(1,2)(3,4)(5,6,7,8)(9,10,11,12)(13,14)(15,16)(17,18)/rA:19cCCCCCCCCCNCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;s10;s11;s11;s13;s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H23N |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 10.2212 |
Area: | 457.881 |
Solvation: | -1.22585 |
Coulombic: | -12.8603 |
Bond Count [?]
All: | 20 |
Single: | 14 |
Double: | 6 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 253.382 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 4.48 |
LogP (Chemaxon): | 4.68 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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