1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol

C11H12FN3O — CID 82870351

IUPAC1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol
SMILESCn1ccc(CC(O)c2ccc(F)cn2)n1
InChIInChI=1S/C11H12FN3O/c1-15-5-4-9(14-15)6-11(16)10-3-2-8(12)7-13-10/h2-5,7,11,16H,6H2,1H3
InChIKeyRXPKFKWEGWAWBX-UHFFFAOYSA-N
MW221.24 g/mol
LogP1.23
Rot. Bonds3

About 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol

1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol (PubChem CID 82870351) has the molecular formula C11H12FN3O and a molecular weight of 221.24 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol
PubChem CID82870351
Molecular FormulaC11H12FN3O
Molecular Weight221.24 g/mol
Exact Mass221.10
IUPAC Name1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol
SMILESCn1ccc(CC(O)c2ccc(F)cn2)n1
InChIInChI=1S/C11H12FN3O/c1-15-5-4-9(14-15)6-11(16)10-3-2-8(12)7-13-10/h2-5,7,11,16H,6H2,1H3
InChIKeyRXPKFKWEGWAWBX-UHFFFAOYSA-N
XLogP1.23
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-fluorophenyl)-2-(1-methylpyrazol-3-yl)ethanol
CID 82868986
1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-(1-methylpyrazol-3-yl)ethanol
CID 82869567
1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
CID 79723827
2-(1-methylpyrazol-3-yl)-1-(thiadiazol-5-yl)ethanol
CID 105121099
3-(4-fluorophenyl)-3-methyl-1-(1-methylpyrazol-3-yl)butan-2-ol
CID 82870006
2-fluoro-3-(1-methylpyrazol-3-yl)propan-1-amine
CID 112562653
(1R)-2-amino-1-(5-fluoro-2-pyridinyl)ethanol
CID 83128440
1-(5-fluoro-2-pyridinyl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanol
CID 79723844
2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 82920135
1-(3-chloro-2-fluorophenyl)-2-(1-methylpyrazol-3-yl)ethanol
CID 82869875
1-(2-bromo-3,4-difluorophenyl)-2-(1-methylpyrazol-3-yl)ethanol
CID 107538377
1-(5-fluoro-2-pyridinyl)-N-methyl-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 79712344

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol (CID 82870351) is 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol is Cn1ccc(CC(O)c2ccc(F)cn2)n1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol?
The InChIKey is RXPKFKWEGWAWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-15-5-4-9(14-15)6-11(16)10-3-2-8(12)7-13-10/h2-5,7,11,16H,6H2,1H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol?
1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol has a molecular weight of 221.24 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol is sourced from PubChem (CID 82870351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).