2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide

C15H13FN4O — CID 118948489

IUPAC2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide
SMILESCC(C(N)=O)(c1cccnc1)c1cc2cn[nH]c2cc1F
InChIInChI=1S/C15H13FN4O/c1-15(14(17)21,10-3-2-4-18-8-10)11-5-9-7-19-20-13(9)6-12(11)16/h2-8H,1H3,(H2,17,21)(H,19,20)
InChIKeyCBCDYCFVTGVBOB-UHFFFAOYSA-N
MW284.29 g/mol
LogP1.89
Rot. Bonds3

About 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide

2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide (PubChem CID 118948489) has the molecular formula C15H13FN4O and a molecular weight of 284.29 g/mol. Its IUPAC name is 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide
PubChem CID118948489
Molecular FormulaC15H13FN4O
Molecular Weight284.29 g/mol
Exact Mass284.11
IUPAC Name2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide
SMILESCC(C(N)=O)(c1cccnc1)c1cc2cn[nH]c2cc1F
InChIInChI=1S/C15H13FN4O/c1-15(14(17)21,10-3-2-4-18-8-10)11-5-9-7-19-20-13(9)6-12(11)16/h2-8H,1H3,(H2,17,21)(H,19,20)
InChIKeyCBCDYCFVTGVBOB-UHFFFAOYSA-N
XLogP1.89
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide?
The IUPAC name of 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide (CID 118948489) is 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide.
What is the SMILES notation for 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide?
The canonical SMILES for 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide is CC(C(N)=O)(c1cccnc1)c1cc2cn[nH]c2cc1F.
What is the InChIKey of 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide?
The InChIKey is CBCDYCFVTGVBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O/c1-15(14(17)21,10-3-2-4-18-8-10)11-5-9-7-19-20-13(9)6-12(11)16/h2-8H,1H3,(H2,17,21)(H,19,20).
What are the key properties of 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide?
2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide has a molecular weight of 284.29 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1H-indazol-5-yl)-2-pyridin-3-ylpropanamide is sourced from PubChem (CID 118948489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).