2-(6-fluoro-2H-indazol-3-yl)propanoic acid

C10H9FN2O2 — CID 83909181

IUPAC2-(6-fluoro-2H-indazol-3-yl)propanoic acid
SMILESCC(C(=O)O)c1[nH]nc2cc(F)ccc12
InChIInChI=1S/C10H9FN2O2/c1-5(10(14)15)9-7-3-2-6(11)4-8(7)12-13-9/h2-5H,1H3,(H,12,13)(H,14,15)
InChIKeyRXTXLOYOUBOODD-UHFFFAOYSA-N
MW208.19 g/mol
LogP1.89
Rot. Bonds2

About 2-(6-fluoro-2H-indazol-3-yl)propanoic acid

2-(6-fluoro-2H-indazol-3-yl)propanoic acid (PubChem CID 83909181) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 2-(6-fluoro-2H-indazol-3-yl)propanoic acid.

Molecular Properties

Compound Name2-(6-fluoro-2H-indazol-3-yl)propanoic acid
PubChem CID83909181
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name2-(6-fluoro-2H-indazol-3-yl)propanoic acid
SMILESCC(C(=O)O)c1[nH]nc2cc(F)ccc12
InChIInChI=1S/C10H9FN2O2/c1-5(10(14)15)9-7-3-2-6(11)4-8(7)12-13-9/h2-5H,1H3,(H,12,13)(H,14,15)
InChIKeyRXTXLOYOUBOODD-UHFFFAOYSA-N
XLogP1.89
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(6-fluoro-2H-indazol-3-yl)propanoic acid
CID 83909180
1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(6-fluoro-2H-indazol-3-yl)propan-2-one
CID 22914823
ethane;6-fluoro-3-methyl-2H-indazole
CID 145099326
1-(6-fluoro-2H-indazol-3-yl)propan-2-amine
CID 83907519
(2R)-2-(4-fluorophenyl)propanoic acid
CID 7005040
4-(6-fluoro-2H-indazol-3-yl)-2-methylbutan-1-ol
CID 57305860
1-(3-propan-2-yl-2H-indazol-6-yl)ethanone
CID 105454475
1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine
CID 83907515
(2S)-2-(2,5-difluorophenyl)propanoic acid
CID 93182242
2-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]propanoic acid
CID 105494091
2-(7-chloro-2H-indazol-3-yl)propanoic acid
CID 83911078
(2R)-1-(5-fluoro-2H-indazol-3-yl)propan-2-amine
CID 92670275

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-2H-indazol-3-yl)propanoic acid?
The IUPAC name of 2-(6-fluoro-2H-indazol-3-yl)propanoic acid (CID 83909181) is 2-(6-fluoro-2H-indazol-3-yl)propanoic acid.
What is the SMILES notation for 2-(6-fluoro-2H-indazol-3-yl)propanoic acid?
The canonical SMILES for 2-(6-fluoro-2H-indazol-3-yl)propanoic acid is CC(C(=O)O)c1[nH]nc2cc(F)ccc12.
What is the InChIKey of 2-(6-fluoro-2H-indazol-3-yl)propanoic acid?
The InChIKey is RXTXLOYOUBOODD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-5(10(14)15)9-7-3-2-6(11)4-8(7)12-13-9/h2-5H,1H3,(H,12,13)(H,14,15).
What are the key properties of 2-(6-fluoro-2H-indazol-3-yl)propanoic acid?
2-(6-fluoro-2H-indazol-3-yl)propanoic acid has a molecular weight of 208.19 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-2H-indazol-3-yl)propanoic acid is sourced from PubChem (CID 83909181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).