Chemical ID: 3992105

c1cc(ccc1c2nnc(o2)N)F
Chemical ID:
3992105
Name [?]:
5-(4-fluorophenyl)-1,3,4-oxadiazol-2-amine
SMILES [?]:
c1cc(ccc1c2nnc(o2)N)F
InChi [?]:
InChI=1/C8H6FN3O/c9-6-3-1-5(2-4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,6,3,7,10,13,12,8,9,11/E:(1,2)(3,4)/rA:13nCCCCCCCNNCONF/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;d9;s7s10;s10;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H6FN3O
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.289
Area:329.547
Solvation:-1.94967
Coulombic:-36.0623
Bond Count [?]
All:14
Single:9
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:179.151
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.73
LogP (Chemaxon):1.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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