Chemical ID: 3965201

c1cc(cnc1)OCC2CCN2
Chemical ID:
3965201
Name [?]:
3-(azetidin-2-ylmethoxy)pyridine
SMILES [?]:
c1cc(cnc1)OCC2CCN2
InChi [?]:
InChI=1/C9H12N2O/c1-2-9(6-10-4-1)12-7-8-3-5-11-8/h1-2,4,6,8,11H,3,5,7H2
InChi Info:
AuxInfo=1/0/N:1,2,10,6,11,4,8,9,3,5,12,7/rA:12cCCCCNCOCCCCN/rB:s1;d2;s3;d4;d1s5;s3;s7;s8;s9;s10;s9s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H12N2O
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:5.72771
Area:338.152
Solvation:-2.72609
Coulombic:-20.7452
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:164.204
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.48
LogP (Chemaxon):0.04

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