(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone

C10H7FN2O2 — CID 2400746

IUPAC(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)c1cc(F)ccc1O
InChIInChI=1S/C10H7FN2O2/c11-7-1-2-9(14)8(3-7)10(15)6-4-12-13-5-6/h1-5,14H,(H,12,13)
InChIKeyAIPGHCGSUWDJOL-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.49
Rot. Bonds2

About (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone

(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone (PubChem CID 2400746) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol. Its IUPAC name is (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone
PubChem CID2400746
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)c1cc(F)ccc1O
InChIInChI=1S/C10H7FN2O2/c11-7-1-2-9(14)8(3-7)10(15)6-4-12-13-5-6/h1-5,14H,(H,12,13)
InChIKeyAIPGHCGSUWDJOL-UHFFFAOYSA-N
XLogP1.49
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone?
The IUPAC name of (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone (CID 2400746) is (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone.
What is the SMILES notation for (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone?
The canonical SMILES for (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone is O=C(c1cn[nH]c1)c1cc(F)ccc1O.
What is the InChIKey of (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone?
The InChIKey is AIPGHCGSUWDJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c11-7-1-2-9(14)8(3-7)10(15)6-4-12-13-5-6/h1-5,14H,(H,12,13).
What are the key properties of (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone?
(5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone has a molecular weight of 206.18 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-hydroxyphenyl)-(1H-pyrazol-4-yl)methanone is sourced from PubChem (CID 2400746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).