2-fluoropyrrolo[2,3-c]pyridin-7-one

C7H3FN2O — CID 174175565

IUPAC2-fluoropyrrolo[2,3-c]pyridin-7-one
SMILESO=C1N=CC=C2C=C(F)N=C12
InChIInChI=1S/C7H3FN2O/c8-5-3-4-1-2-9-7(11)6(4)10-5/h1-3H
InChIKeyDPZSWGCJGCSTSH-UHFFFAOYSA-N
MW150.11 g/mol
LogP0.79
Rot. Bonds

About 2-fluoropyrrolo[2,3-c]pyridin-7-one

2-fluoropyrrolo[2,3-c]pyridin-7-one (PubChem CID 174175565) has the molecular formula C7H3FN2O and a molecular weight of 150.11 g/mol. Its IUPAC name is 2-fluoropyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name2-fluoropyrrolo[2,3-c]pyridin-7-one
PubChem CID174175565
Molecular FormulaC7H3FN2O
Molecular Weight150.11 g/mol
Exact Mass150.02
IUPAC Name2-fluoropyrrolo[2,3-c]pyridin-7-one
SMILESO=C1N=CC=C2C=C(F)N=C12
InChIInChI=1S/C7H3FN2O/c8-5-3-4-1-2-9-7(11)6(4)10-5/h1-3H
InChIKeyDPZSWGCJGCSTSH-UHFFFAOYSA-N
XLogP0.79
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.11
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoropyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 2-fluoropyrrolo[2,3-c]pyridin-7-one (CID 174175565) is 2-fluoropyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 2-fluoropyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 2-fluoropyrrolo[2,3-c]pyridin-7-one is O=C1N=CC=C2C=C(F)N=C12.
What is the InChIKey of 2-fluoropyrrolo[2,3-c]pyridin-7-one?
The InChIKey is DPZSWGCJGCSTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3FN2O/c8-5-3-4-1-2-9-7(11)6(4)10-5/h1-3H.
What are the key properties of 2-fluoropyrrolo[2,3-c]pyridin-7-one?
2-fluoropyrrolo[2,3-c]pyridin-7-one has a molecular weight of 150.11 g/mol, XLogP of 0.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 174175565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).