1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol

C11H14FNO2 — CID 104737979

IUPAC1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol
SMILESOC(CC1CCCO1)c1ccncc1F
InChIInChI=1S/C11H14FNO2/c12-10-7-13-4-3-9(10)11(14)6-8-2-1-5-15-8/h3-4,7-8,11,14H,1-2,5-6H2
InChIKeyBLCLSEGRPDPSAM-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.82
Rot. Bonds3

About 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol

1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol (PubChem CID 104737979) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol
PubChem CID104737979
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol
SMILESOC(CC1CCCO1)c1ccncc1F
InChIInChI=1S/C11H14FNO2/c12-10-7-13-4-3-9(10)11(14)6-8-2-1-5-15-8/h3-4,7-8,11,14H,1-2,5-6H2
InChIKeyBLCLSEGRPDPSAM-UHFFFAOYSA-N
XLogP1.82
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanol
CID 66271830
1-(3-fluoro-4-pyridinyl)-3-(oxan-2-yl)propan-1-ol
CID 115833989
2-(oxolan-2-yl)-1-pyrazin-2-ylethanol
CID 62608593
1-(4-fluoronaphthalen-1-yl)-2-(oxolan-2-yl)ethanol
CID 65157648
1-(5-bromo-2-fluorophenyl)-2-(oxolan-2-yl)ethanol
CID 65148287
1-(5-fluoro-2-methylphenyl)-2-(oxolan-2-yl)ethanol
CID 62608272
1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol
CID 62606205
N-ethyl-1-(3-fluoro-4-pyridinyl)-3-(oxan-2-yl)propan-1-amine
CID 105038119
N-methyl-1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanamine
CID 66272484
1-(3-methoxy-4-pyridinyl)-3-(oxolan-2-yl)propan-1-ol
CID 105066320
1-(2,4-difluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65160611
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(oxolan-2-yl)ethanol
CID 103396051

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol?
The IUPAC name of 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol (CID 104737979) is 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol.
What is the SMILES notation for 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol?
The canonical SMILES for 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol is OC(CC1CCCO1)c1ccncc1F.
What is the InChIKey of 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol?
The InChIKey is BLCLSEGRPDPSAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-10-7-13-4-3-9(10)11(14)6-8-2-1-5-15-8/h3-4,7-8,11,14H,1-2,5-6H2.
What are the key properties of 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol?
1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol has a molecular weight of 211.24 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol is sourced from PubChem (CID 104737979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).