Chemical ID: 7106987

CC(C)(C)NCc1ccc(cc1)OCc2ccccc2
Chemical ID:
7106987
Name [?]:
N-[(4-benzyloxyphenyl)methyl]-2-methyl-propan-2-amine
SMILES [?]:
CC(C)(C)NCc1ccc(cc1)OCc2ccccc2
InChi [?]:
InChI=1/C18H23NO/c1-18(2,3)19-13-15-9-11-17(12-10-15)20-14-16-7-5-4-6-8-16/h4-12,19H,13-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,18,17,19,16,20,8,12,9,11,6,14,7,15,10,2,5,13/E:(1,2,3)(5,6)(7,8)(9,10)(11,12)/rA:20nCCCCNCCCCCCCOCCCCCCC/rB:s1;s2;s2;s2;s5;s6;s7;d8;s9;d10;d7s11;s10;s13;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H23NO
All Atoms:43
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.88396
Area:500.752
Solvation:-2.63483
Coulombic:-19.2813
Bond Count [?]
All:21
Single:15
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.381
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.46
LogP (Chemaxon):3.93

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