Chemical ID: 7509170

CC(Cc1ccc(cc1)OC)NCc2cccc(c2)Cl
Chemical ID:
7509170
Name [?]:
N-[(3-chlorophenyl)methyl]-1-(4-methoxyphenyl)-propan-2-amine
SMILES [?]:
CC(Cc1ccc(cc1)OC)NCc2cccc(c2)Cl
InChi [?]:
InChI=1/C17H20ClNO/c1-13(10-14-6-8-17(20-2)9-7-14)19-12-15-4-3-5-16(18)11-15/h3-9,11,13,19H,10,12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,16,15,17,5,9,6,8,3,19,13,2,4,14,18,7,20,12,10/E:(6,7)(8,9)/rA:20cCCCCCCCCCOCNCCCCCCCCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s2;s12;s13;s14;d15;s16;d17;d14s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H20ClNO
All Atoms:40
Heavy Atoms:20
Chiral Atoms:None
ZAP Information [?]
Total:10.0317
Area:506.048
Solvation:-2.61949
Coulombic:-19.0526
Bond Count [?]
All:21
Single:15
Double:6
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.4
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue