1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol

C14H17FN2O2 — CID 114556790

IUPAC1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol
SMILESCCn1nccc1C(O)Cc1cccc(OC)c1F
InChIInChI=1S/C14H17FN2O2/c1-3-17-11(7-8-16-17)12(18)9-10-5-4-6-13(19-2)14(10)15/h4-8,12,18H,3,9H2,1-2H3
InChIKeyZZFKCAGQHDXLJF-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.33
Rot. Bonds5

About 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol

1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol (PubChem CID 114556790) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol
PubChem CID114556790
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC Name1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol
SMILESCCn1nccc1C(O)Cc1cccc(OC)c1F
InChIInChI=1S/C14H17FN2O2/c1-3-17-11(7-8-16-17)12(18)9-10-5-4-6-13(19-2)14(10)15/h4-8,12,18H,3,9H2,1-2H3
InChIKeyZZFKCAGQHDXLJF-UHFFFAOYSA-N
XLogP2.33
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 114556975
2-(2-fluoro-3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol
CID 114554076
1-(2-ethylpyrazol-3-yl)-2-(2-fluorophenyl)ethanol
CID 63977415
2-(2-fluoro-3-methoxyphenyl)-1-pyrimidin-2-ylethanol
CID 104793572
1-(2-ethylpyrazol-3-yl)-2-(4-fluorophenyl)ethanol
CID 63975289
2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 104793189
[1-(2-ethylpyrazol-3-yl)-2-(2-methoxyphenyl)ethyl]hydrazine
CID 105205035
N-[2-(2-fluoro-3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 105180698
2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol
CID 104793076
1-[(2-fluoro-3-methoxyphenyl)methyl]-5-methylpyrazole
CID 104794972
2-(2-fluoro-3-methoxyphenyl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 104793243
1-(4-aminophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanol
CID 106695530

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol?
The IUPAC name of 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol (CID 114556790) is 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol is CCn1nccc1C(O)Cc1cccc(OC)c1F.
What is the InChIKey of 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol?
The InChIKey is ZZFKCAGQHDXLJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c1-3-17-11(7-8-16-17)12(18)9-10-5-4-6-13(19-2)14(10)15/h4-8,12,18H,3,9H2,1-2H3.
What are the key properties of 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol?
1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol has a molecular weight of 264.30 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol is sourced from PubChem (CID 114556790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).