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U1Q : Summary

Code

U1Q

One-letter code

X

Molecule name

5-fluoranylpyridin-2-amine

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 5-fluoranylpyridin-2-amine

Formula

C5 H5 F N2

Formal charge

0

Molecular weight

112.105 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 Nc1ccc(F)cn1
SMILES OpenEye OEToolkits 2.0.7 c1cc(ncc1F)N
Canonical SMILES CACTVS 3.385 Nc1ccc(F)cn1
Canonical SMILES OpenEye OEToolkits 2.0.7 c1cc(ncc1F)N

IUPAC InChI

InChI=1S/C5H5FN2/c6-4-1-2-5(7)8-3-4/h1-3H,(H2,7,8)

IUPAC InChI key

YJTXQLYMECWULH-UHFFFAOYSA-N
U1Q

wwPDB Information

Atom count

13 (8 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2021-01-18

Last modified at

2022-02-25

Status

Released

Obsoleted

Not Assigned