4-fluoro-1-methylpyrrolo[2,3-b]pyridine

C8H7FN2 — CID 58195536

IUPAC4-fluoro-1-methylpyrrolo[2,3-b]pyridine
SMILESCn1ccc2c(F)ccnc21
InChIInChI=1S/C8H7FN2/c1-11-5-3-6-7(9)2-4-10-8(6)11/h2-5H,1H3
InChIKeyWZVOCXGYCWUYHK-UHFFFAOYSA-N
MW150.16 g/mol
LogP1.71
Rot. Bonds

About 4-fluoro-1-methylpyrrolo[2,3-b]pyridine

4-fluoro-1-methylpyrrolo[2,3-b]pyridine (PubChem CID 58195536) has the molecular formula C8H7FN2 and a molecular weight of 150.16 g/mol. Its IUPAC name is 4-fluoro-1-methylpyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4-fluoro-1-methylpyrrolo[2,3-b]pyridine
PubChem CID58195536
Molecular FormulaC8H7FN2
Molecular Weight150.16 g/mol
Exact Mass150.06
IUPAC Name4-fluoro-1-methylpyrrolo[2,3-b]pyridine
SMILESCn1ccc2c(F)ccnc21
InChIInChI=1S/C8H7FN2/c1-11-5-3-6-7(9)2-4-10-8(6)11/h2-5H,1H3
InChIKeyWZVOCXGYCWUYHK-UHFFFAOYSA-N
XLogP1.71
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.16
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methylpyrrolo[2,3-b]pyridine?
The IUPAC name of 4-fluoro-1-methylpyrrolo[2,3-b]pyridine (CID 58195536) is 4-fluoro-1-methylpyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-fluoro-1-methylpyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-fluoro-1-methylpyrrolo[2,3-b]pyridine is Cn1ccc2c(F)ccnc21.
What is the InChIKey of 4-fluoro-1-methylpyrrolo[2,3-b]pyridine?
The InChIKey is WZVOCXGYCWUYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2/c1-11-5-3-6-7(9)2-4-10-8(6)11/h2-5H,1H3.
What are the key properties of 4-fluoro-1-methylpyrrolo[2,3-b]pyridine?
4-fluoro-1-methylpyrrolo[2,3-b]pyridine has a molecular weight of 150.16 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methylpyrrolo[2,3-b]pyridine is sourced from PubChem (CID 58195536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).