1-fluoro-2-pyridin-3-ylpropan-2-ol

C8H10FNO — CID 89407695

IUPAC1-fluoro-2-pyridin-3-ylpropan-2-ol
SMILESCC(O)(CF)c1cccnc1
InChIInChI=1S/C8H10FNO/c1-8(11,6-9)7-3-2-4-10-5-7/h2-5,11H,6H2,1H3
InChIKeyMCWJIIMIKCWOFW-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.26
Rot. Bonds2

About 1-fluoro-2-pyridin-3-ylpropan-2-ol

1-fluoro-2-pyridin-3-ylpropan-2-ol (PubChem CID 89407695) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 1-fluoro-2-pyridin-3-ylpropan-2-ol.

Molecular Properties

Compound Name1-fluoro-2-pyridin-3-ylpropan-2-ol
PubChem CID89407695
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name1-fluoro-2-pyridin-3-ylpropan-2-ol
SMILESCC(O)(CF)c1cccnc1
InChIInChI=1S/C8H10FNO/c1-8(11,6-9)7-3-2-4-10-5-7/h2-5,11H,6H2,1H3
InChIKeyMCWJIIMIKCWOFW-UHFFFAOYSA-N
XLogP1.26
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-3-pyridin-3-ylbutanenitrile
CID 165356102
1-(4-tert-butylphenyl)-2-pyridin-3-ylpropan-2-ol
CID 13120935
1,1,1-trifluoro-2-pyridin-3-ylpropan-2-ol
CID 2748409
(2R)-1,1,1-trifluoro-2-pyridin-3-ylpropan-2-ol
CID 7053126
2,4-dimethyl-4-pyridin-3-ylpentan-2-ol
CID 145044151
2-pyridin-3-ylhex-5-en-2-ol
CID 15642446
tripyridin-3-ylmethanol
CID 177395677
2-methyl-2-pyridin-3-ylpropane-1,3-diol
CID 130130273
1-(5-fluoro-2-methylphenyl)-2-pyridin-3-ylpropan-2-ol
CID 114080751
3-methyl-2-pyridin-3-ylbutan-2-ol
CID 58641587
4-(2-methylpropylamino)-2-pyridin-3-ylbutan-2-ol
CID 66002674
3-hydroxy-3-pyridin-3-ylbutan-2-one
CID 4912937

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-pyridin-3-ylpropan-2-ol?
The IUPAC name of 1-fluoro-2-pyridin-3-ylpropan-2-ol (CID 89407695) is 1-fluoro-2-pyridin-3-ylpropan-2-ol.
What is the SMILES notation for 1-fluoro-2-pyridin-3-ylpropan-2-ol?
The canonical SMILES for 1-fluoro-2-pyridin-3-ylpropan-2-ol is CC(O)(CF)c1cccnc1.
What is the InChIKey of 1-fluoro-2-pyridin-3-ylpropan-2-ol?
The InChIKey is MCWJIIMIKCWOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-8(11,6-9)7-3-2-4-10-5-7/h2-5,11H,6H2,1H3.
What are the key properties of 1-fluoro-2-pyridin-3-ylpropan-2-ol?
1-fluoro-2-pyridin-3-ylpropan-2-ol has a molecular weight of 155.17 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-pyridin-3-ylpropan-2-ol is sourced from PubChem (CID 89407695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).