[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol

C11H11FN2O2 — CID 106530236

IUPAC[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol
SMILESCn1cc(Oc2cc(F)cc(CO)c2)cn1
InChIInChI=1S/C11H11FN2O2/c1-14-6-11(5-13-14)16-10-3-8(7-15)2-9(12)4-10/h2-6,15H,7H2,1H3
InChIKeyUCXQPQHNYPAMLD-UHFFFAOYSA-N
MW222.22 g/mol
LogP1.84
Rot. Bonds3

About [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol

[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol (PubChem CID 106530236) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol
PubChem CID106530236
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol
SMILESCn1cc(Oc2cc(F)cc(CO)c2)cn1
InChIInChI=1S/C11H11FN2O2/c1-14-6-11(5-13-14)16-10-3-8(7-15)2-9(12)4-10/h2-6,15H,7H2,1H3
InChIKeyUCXQPQHNYPAMLD-UHFFFAOYSA-N
XLogP1.84
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-fluoro-5-[2-(1-methylpyrazol-4-yl)ethoxy]phenyl]methanol
CID 103003622
2-[3-fluoro-5-(1-propylpyrazol-4-yl)oxyphenyl]ethanamine
CID 106533561
[4-(1-methylpyrazol-4-yl)oxy-3-(trifluoromethyl)phenyl]methanol
CID 116793015
[2-(1-methylpyrazol-4-yl)oxy-6-propyl-4-pyridinyl]methanol
CID 116793263
(3-fluoro-5-methoxyphenyl)methanol
CID 26985456
2-[3-(1-ethylpyrazol-4-yl)oxy-5-fluorophenyl]ethanamine
CID 106533557
3-fluoro-5-(1-propylpyrazol-4-yl)oxyaniline
CID 116800410
[3-fluoro-5-[(1-methylpyrazol-4-yl)oxymethyl]phenyl]methanamine
CID 116792491
2-[3-fluoro-5-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 106533565
N-[[3-fluoro-5-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]methyl]cyclopropanamine
CID 106533566
[3-(4-butylphenoxy)-5-fluorophenyl]methanol
CID 106530226
[3-fluoro-5-[4-(2-methoxyethyl)phenoxy]phenyl]methanol
CID 106530155

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol?
The IUPAC name of [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol (CID 106530236) is [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol.
What is the SMILES notation for [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol?
The canonical SMILES for [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol is Cn1cc(Oc2cc(F)cc(CO)c2)cn1.
What is the InChIKey of [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol?
The InChIKey is UCXQPQHNYPAMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c1-14-6-11(5-13-14)16-10-3-8(7-15)2-9(12)4-10/h2-6,15H,7H2,1H3.
What are the key properties of [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol?
[3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol has a molecular weight of 222.22 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-5-(1-methylpyrazol-4-yl)oxyphenyl]methanol is sourced from PubChem (CID 106530236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).