Chemical ID: 6482922

c1cc2c(cc1CNC3CC3)CCO2
Chemical ID:
6482922
Name [?]:
N-(2,3-dihydrobenzofuran-5-ylmethyl)cyclopropanamine
SMILES [?]:
c1cc2c(cc1CNC3CC3)CCO2
InChi [?]:
InChI=1/C12H15NO/c1-4-12-10(5-6-14-12)7-9(1)8-13-11-2-3-11/h1,4,7,11,13H,2-3,5-6,8H2
InChi Info:
AuxInfo=1/0/N:1,10,11,2,12,13,5,7,6,4,9,3,8,14/E:(2,3)/rA:14nCCCCCCCNCCCCCO/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s9s10;s4;s12;s3s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.12557
Area:377.332
Solvation:-2.30772
Coulombic:-16.628
Bond Count [?]
All:16
Single:13
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:189.254
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.84
LogP (Chemaxon):1.7

Name Annotations

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Descriptor Annotations

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