5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium

C7H4FN2+ — CID 58259292

IUPAC5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium
SMILESFc1cnc2c(c1)C=[C+]N2
InChIInChI=1S/C7H4FN2/c8-6-3-5-1-2-9-7(5)10-4-6/h1,3-4H,(H,9,10)/q+1
InChIKeyOUONMOVSCSQLIT-UHFFFAOYSA-N
MW135.12 g/mol
LogP1.42
Rot. Bonds

About 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium

5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium (PubChem CID 58259292) has the molecular formula C7H4FN2+ and a molecular weight of 135.12 g/mol. Its IUPAC name is 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium.

Molecular Properties

Compound Name5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium
PubChem CID58259292
Molecular FormulaC7H4FN2+
Molecular Weight135.12 g/mol
Exact Mass135.04
IUPAC Name5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium
SMILESFc1cnc2c(c1)C=[C+]N2
InChIInChI=1S/C7H4FN2/c8-6-3-5-1-2-9-7(5)10-4-6/h1,3-4H,(H,9,10)/q+1
InChIKeyOUONMOVSCSQLIT-UHFFFAOYSA-N
XLogP1.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.12
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-1,4-dihydropyrido[2,3-d][1,3]thiazin-2-one
CID 142907207
CID 155712415
CID 155712415
5-fluoro-2,3-dimethylpyridine
CID 45079981
4-fluoro-6-(5-fluoropyrimidin-2-yl)pyrimidine
CID 178126913
2,6-bis(3,5-difluoro-2-pyridinyl)-3,5-difluoropyridine
CID 90084661
6-fluoro-N-methyl-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 138546468
2-bromo-5-fluoropyridine-3-thiol
CID 119001198
3-(difluoromethyl)-2,5-difluoropyridine
CID 70480194
6-fluoro-3H-[1,3]oxazolo[4,5-b]pyridine-2-thione
CID 155701556
ethane;5-fluoro-3-(5-fluoropyrimidin-2-yl)-1H-pyrrolo[2,3-b]pyridine
CID 144524176
4-(5-fluoro-3-methyl-2-pyridinyl)but-3-yn-2-ol
CID 122242546
6-fluorospiro[1,4-dihydro-1,8-naphthyridine-3,4'-cyclohexane]-1',2-dione
CID 144753731

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium?
The IUPAC name of 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium (CID 58259292) is 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium.
What is the SMILES notation for 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium?
The canonical SMILES for 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium is Fc1cnc2c(c1)C=[C+]N2.
What is the InChIKey of 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium?
The InChIKey is OUONMOVSCSQLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4FN2/c8-6-3-5-1-2-9-7(5)10-4-6/h1,3-4H,(H,9,10)/q+1.
What are the key properties of 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium?
5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium has a molecular weight of 135.12 g/mol, XLogP of 1.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium is sourced from PubChem (CID 58259292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).