(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol

C11H11FN2O — CID 63961772

IUPAC(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol
SMILESCn1nccc1C(O)c1ccccc1F
InChIInChI=1S/C11H11FN2O/c1-14-10(6-7-13-14)11(15)8-4-2-3-5-9(8)12/h2-7,11,15H,1H3
InChIKeyAFNFESRPBGSAHN-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.64
Rot. Bonds2

About (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol

(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol (PubChem CID 63961772) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol
PubChem CID63961772
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol
SMILESCn1nccc1C(O)c1ccccc1F
InChIInChI=1S/C11H11FN2O/c1-14-10(6-7-13-14)11(15)8-4-2-3-5-9(8)12/h2-7,11,15H,1H3
InChIKeyAFNFESRPBGSAHN-UHFFFAOYSA-N
XLogP1.64
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol?
The IUPAC name of (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol (CID 63961772) is (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol.
What is the SMILES notation for (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol?
The canonical SMILES for (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol is Cn1nccc1C(O)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol?
The InChIKey is AFNFESRPBGSAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-14-10(6-7-13-14)11(15)8-4-2-3-5-9(8)12/h2-7,11,15H,1H3.
What are the key properties of (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol?
(2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol has a molecular weight of 206.22 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(2-methylpyrazol-3-yl)methanol is sourced from PubChem (CID 63961772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).