3-(4-fluoropyrazol-1-yl)-4-methoxyphenol

C10H9FN2O2 — CID 175888263

IUPAC3-(4-fluoropyrazol-1-yl)-4-methoxyphenol
SMILESCOc1ccc(O)cc1-n1cc(F)cn1
InChIInChI=1S/C10H9FN2O2/c1-15-10-3-2-8(14)4-9(10)13-6-7(11)5-12-13/h2-6,14H,1H3
InChIKeyGCKLASROZSNUMH-UHFFFAOYSA-N
MW208.19 g/mol
LogP1.73
Rot. Bonds2

About 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol

3-(4-fluoropyrazol-1-yl)-4-methoxyphenol (PubChem CID 175888263) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol.

Molecular Properties

Compound Name3-(4-fluoropyrazol-1-yl)-4-methoxyphenol
PubChem CID175888263
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name3-(4-fluoropyrazol-1-yl)-4-methoxyphenol
SMILESCOc1ccc(O)cc1-n1cc(F)cn1
InChIInChI=1S/C10H9FN2O2/c1-15-10-3-2-8(14)4-9(10)13-6-7(11)5-12-13/h2-6,14H,1H3
InChIKeyGCKLASROZSNUMH-UHFFFAOYSA-N
XLogP1.73
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol?
The IUPAC name of 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol (CID 175888263) is 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol.
What is the SMILES notation for 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol?
The canonical SMILES for 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol is COc1ccc(O)cc1-n1cc(F)cn1.
What is the InChIKey of 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol?
The InChIKey is GCKLASROZSNUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-15-10-3-2-8(14)4-9(10)13-6-7(11)5-12-13/h2-6,14H,1H3.
What are the key properties of 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol?
3-(4-fluoropyrazol-1-yl)-4-methoxyphenol has a molecular weight of 208.19 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoropyrazol-1-yl)-4-methoxyphenol is sourced from PubChem (CID 175888263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).