5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine

C12H11F2N3 — CID 171092559

IUPAC5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1cc(F)cnc1-c1ccnc(F)c1
InChIInChI=1S/C12H11F2N3/c1-17(2)10-6-9(13)7-16-12(10)8-3-4-15-11(14)5-8/h3-7H,1-2H3
InChIKeyFENUTBFRTBOFAB-UHFFFAOYSA-N
MW235.24 g/mol
LogP2.49
Rot. Bonds2

About 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine

5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine (PubChem CID 171092559) has the molecular formula C12H11F2N3 and a molecular weight of 235.24 g/mol. Its IUPAC name is 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine
PubChem CID171092559
Molecular FormulaC12H11F2N3
Molecular Weight235.24 g/mol
Exact Mass235.09
IUPAC Name5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1cc(F)cnc1-c1ccnc(F)c1
InChIInChI=1S/C12H11F2N3/c1-17(2)10-6-9(13)7-16-12(10)8-3-4-15-11(14)5-8/h3-7H,1-2H3
InChIKeyFENUTBFRTBOFAB-UHFFFAOYSA-N
XLogP2.49
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-4-(4-fluorophenyl)pyridine
CID 46312736
2-fluoro-4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine
CID 22037455
2-fluoro-4-(2,3,4,5,6-pentafluorophenyl)pyridine
CID 133088728
3-(2-fluoro-4-pyridinyl)-7,7-dimethyl-4-propan-2-yl-5,6-dihydrocyclopenta[c]pyridine
CID 167358994
4-(2-bromophenyl)-2-fluoropyridine
CID 168810872
3-(2-fluoro-4-pyridinyl)-4-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 146613270
3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine
CID 50978797
2-(2-fluoro-4-pyridinyl)benzene-1,4-diamine
CID 18415383
5-fluoro-3-methyl-2-phenylpyridine
CID 46314858
2-fluoro-4-(4-pyridin-3-yl-1H-imidazol-5-yl)pyridine;hydrate
CID 162328414
4-(4,5-dimethylthiophen-2-yl)-2-fluoropyridine
CID 58095055
[2-(2-fluoro-4-pyridinyl)phenyl]methanamine
CID 71114270

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine?
The IUPAC name of 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine (CID 171092559) is 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine.
What is the SMILES notation for 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine?
The canonical SMILES for 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine is CN(C)c1cc(F)cnc1-c1ccnc(F)c1.
What is the InChIKey of 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine?
The InChIKey is FENUTBFRTBOFAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2N3/c1-17(2)10-6-9(13)7-16-12(10)8-3-4-15-11(14)5-8/h3-7H,1-2H3.
What are the key properties of 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine?
5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine has a molecular weight of 235.24 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(2-fluoro-4-pyridinyl)-N,N-dimethylpyridin-3-amine is sourced from PubChem (CID 171092559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).