Chemical ID: 7106832

COc1ccc(cc1)CNC2CC2
Chemical ID:
7106832
Name [?]:
N-[(4-methoxyphenyl)methyl]cyclopropanamine
SMILES [?]:
COc1ccc(cc1)CNC2CC2
InChi [?]:
InChI=1/C11H15NO/c1-13-11-6-2-9(3-7-11)8-12-10-4-5-10/h2-3,6-7,10,12H,4-5,8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,5,7,12,13,4,8,9,6,11,3,10,2/E:(2,3)(4,5)(6,7)/rA:13nCOCCCCCCCNCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;s11;s11s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15NO
All Atoms:28
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.87862
Area:370.642
Solvation:-2.38743
Coulombic:-16.8307
Bond Count [?]
All:14
Single:11
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:177.243
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.99
LogP (Chemaxon):1.72

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