[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol

C11H11FN2O — CID 115093183

IUPAC[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol
SMILESCn1nc(-c2ccccc2F)cc1CO
InChIInChI=1S/C11H11FN2O/c1-14-8(7-15)6-11(13-14)9-4-2-3-5-10(9)12/h2-6,15H,7H2,1H3
InChIKeySUMADJCTDZHOTA-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.72
Rot. Bonds2

About [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol

[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol (PubChem CID 115093183) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol.

Molecular Properties

Compound Name[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol
PubChem CID115093183
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol
SMILESCn1nc(-c2ccccc2F)cc1CO
InChIInChI=1S/C11H11FN2O/c1-14-8(7-15)6-11(13-14)9-4-2-3-5-10(9)12/h2-6,15H,7H2,1H3
InChIKeySUMADJCTDZHOTA-UHFFFAOYSA-N
XLogP1.72
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 ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-(2-fluorophenyl)-1-methylpyrazole
CID 84678019
N-[2-(dimethylamino)ethyl]-3-(2-fluorophenyl)-1-methylpyrazole-5-carboxamide
CID 812295
3-(2-chlorophenyl)-5-ethyl-1-methylpyrazole
CID 70791545
[1-methyl-3-(5-methylthiophen-2-yl)pyrazol-5-yl]methanol
CID 115092905
[3-(5-bromofuran-2-yl)-1-methylpyrazol-5-yl]methanol
CID 115092903
[4-(2-fluorophenyl)-1-methylpyrazol-3-yl]methanol
CID 105423075
N-(1,2-diphenylethyl)-3-(2-fluorophenyl)-1-methylpyrazole-5-carboxamide
CID 5021989
N-[1-[[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methyl]piperidin-4-yl]-2-morpholin-4-ylpropanamide
CID 110217989
methyl 1-(2-chloroethyl)-3-(2-fluorophenyl)pyrazole-5-carboxylate
CID 170977529
methyl 2-[5-(bromomethyl)-1-methylpyrazol-3-yl]benzoate
CID 175002347
ethyl 1-[3-(2-fluorophenyl)-1-methylpyrazole-5-carbonyl]piperidine-4-carboxylate
CID 4015862
5-(2-fluorophenyl)-1-methylpyrazole-3-carboxylic acid
CID 62268890

Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol?
The IUPAC name of [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol (CID 115093183) is [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol.
What is the SMILES notation for [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol?
The canonical SMILES for [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol is Cn1nc(-c2ccccc2F)cc1CO.
What is the InChIKey of [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol?
The InChIKey is SUMADJCTDZHOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-14-8(7-15)6-11(13-14)9-4-2-3-5-10(9)12/h2-6,15H,7H2,1H3.
What are the key properties of [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol?
[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol has a molecular weight of 206.22 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorophenyl)-1-methylpyrazol-5-yl]methanol is sourced from PubChem (CID 115093183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).