5-fluoro-1-(5-fluoro-3-pyridinyl)indazole

C12H7F2N3 — CID 90252839

IUPAC5-fluoro-1-(5-fluoro-3-pyridinyl)indazole
SMILESFc1cncc(-n2ncc3cc(F)ccc32)c1
InChIInChI=1S/C12H7F2N3/c13-9-1-2-12-8(3-9)5-16-17(12)11-4-10(14)6-15-7-11/h1-7H
InChIKeyVODVMLPDFDPARC-UHFFFAOYSA-N
MW231.21 g/mol
LogP2.70
Rot. Bonds1

About 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole

5-fluoro-1-(5-fluoro-3-pyridinyl)indazole (PubChem CID 90252839) has the molecular formula C12H7F2N3 and a molecular weight of 231.21 g/mol. Its IUPAC name is 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole.

Molecular Properties

Compound Name5-fluoro-1-(5-fluoro-3-pyridinyl)indazole
PubChem CID90252839
Molecular FormulaC12H7F2N3
Molecular Weight231.21 g/mol
Exact Mass231.06
IUPAC Name5-fluoro-1-(5-fluoro-3-pyridinyl)indazole
SMILESFc1cncc(-n2ncc3cc(F)ccc32)c1
InChIInChI=1S/C12H7F2N3/c13-9-1-2-12-8(3-9)5-16-17(12)11-4-10(14)6-15-7-11/h1-7H
InChIKeyVODVMLPDFDPARC-UHFFFAOYSA-N
XLogP2.70
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.21
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole?
The IUPAC name of 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole (CID 90252839) is 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole.
What is the SMILES notation for 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole?
The canonical SMILES for 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole is Fc1cncc(-n2ncc3cc(F)ccc32)c1.
What is the InChIKey of 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole?
The InChIKey is VODVMLPDFDPARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2N3/c13-9-1-2-12-8(3-9)5-16-17(12)11-4-10(14)6-15-7-11/h1-7H.
What are the key properties of 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole?
5-fluoro-1-(5-fluoro-3-pyridinyl)indazole has a molecular weight of 231.21 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(5-fluoro-3-pyridinyl)indazole is sourced from PubChem (CID 90252839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).