6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

C7H7FN2 — CID 142308840

IUPAC6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESFC1CC=c2cc[nH]c2=N1
InChIInChI=1S/C7H7FN2/c8-6-2-1-5-3-4-9-7(5)10-6/h1,3-4,6H,2H2,(H,9,10)
InChIKeyBFVVTYAUBLTOCA-UHFFFAOYSA-N
MW138.14 g/mol
LogP0.11
Rot. Bonds

About 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (PubChem CID 142308840) has the molecular formula C7H7FN2 and a molecular weight of 138.14 g/mol. Its IUPAC name is 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
PubChem CID142308840
Molecular FormulaC7H7FN2
Molecular Weight138.14 g/mol
Exact Mass138.06
IUPAC Name6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESFC1CC=c2cc[nH]c2=N1
InChIInChI=1S/C7H7FN2/c8-6-2-1-5-3-4-9-7(5)10-6/h1,3-4,6H,2H2,(H,9,10)
InChIKeyBFVVTYAUBLTOCA-UHFFFAOYSA-N
XLogP0.11
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.14
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

5,6-Dihydro-7-azaindole
CID 70639991
4-(2-fluoro-1,2-dihydropyridin-6-yl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 88909184
4-fluoro-3,5-dimethyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 124026877
6-fluoro-2-iodo-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 134376306
3-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridin-1-ium
CID 163621742
(3Z)-3-ethylidene-N-(1-fluoroethyl)-1H-pyrrol-2-imine
CID 173810774
(3Z)-3-ethylidene-N-(fluoromethyl)-1H-pyrrol-2-imine
CID 173891209
3-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 163621743
1,4-Dihydropyrrolo[2,3-b]pyridin-4-ide;tungsten
CID 58431408
5-chloro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 89259806
(5R)-5-chloro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 89260859
(3Z)-4-(aminomethyl)-N-ethenyl-3-ethylidenepyrrol-2-amine
CID 89289290

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (CID 142308840) is 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is FC1CC=c2cc[nH]c2=N1.
What is the InChIKey of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is BFVVTYAUBLTOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2/c8-6-2-1-5-3-4-9-7(5)10-6/h1,3-4,6H,2H2,(H,9,10).
What are the key properties of 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 138.14 g/mol, XLogP of 0.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 142308840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).