Chemical ID: 7244613

c1ccc2c(c1)nc(o2)C3CCCCN3
Chemical ID:
7244613
Name [?]:
2-(2-piperidyl)benzooxazole
SMILES [?]:
c1ccc2c(c1)nc(o2)C3CCCCN3
InChi [?]:
InChI=1/C12H14N2O/c1-2-7-11-9(5-1)14-12(15-11)10-6-3-4-8-13-10/h1-2,5,7,10,13H,3-4,6,8H2
InChi Info:
AuxInfo=1/0/N:1,2,12,13,6,11,3,14,5,10,4,8,15,7,9/rA:15cCCCCCCNCOCCCCCN/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H14N2O
All Atoms:29
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.46196
Area:371.327
Solvation:-1.8212
Coulombic:-23.8807
Bond Count [?]
All:17
Single:13
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:202.252
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.7
LogP (Chemaxon):2.43

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