2-(6-fluoro-3-pyridinyl)propan-2-ol

C8H10FNO — CID 69476595

IUPAC2-(6-fluoro-3-pyridinyl)propan-2-ol
SMILESCC(C)(O)c1ccc(F)nc1
InChIInChI=1S/C8H10FNO/c1-8(2,11)6-3-4-7(9)10-5-6/h3-5,11H,1-2H3
InChIKeyKUADCUGOGQASNR-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.45
Rot. Bonds1

About 2-(6-fluoro-3-pyridinyl)propan-2-ol

2-(6-fluoro-3-pyridinyl)propan-2-ol (PubChem CID 69476595) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 2-(6-fluoro-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name2-(6-fluoro-3-pyridinyl)propan-2-ol
PubChem CID69476595
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name2-(6-fluoro-3-pyridinyl)propan-2-ol
SMILESCC(C)(O)c1ccc(F)nc1
InChIInChI=1S/C8H10FNO/c1-8(2,11)6-3-4-7(9)10-5-6/h3-5,11H,1-2H3
InChIKeyKUADCUGOGQASNR-UHFFFAOYSA-N
XLogP1.45
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-3-pyridinyl)propan-2-ol?
The IUPAC name of 2-(6-fluoro-3-pyridinyl)propan-2-ol (CID 69476595) is 2-(6-fluoro-3-pyridinyl)propan-2-ol.
What is the SMILES notation for 2-(6-fluoro-3-pyridinyl)propan-2-ol?
The canonical SMILES for 2-(6-fluoro-3-pyridinyl)propan-2-ol is CC(C)(O)c1ccc(F)nc1.
What is the InChIKey of 2-(6-fluoro-3-pyridinyl)propan-2-ol?
The InChIKey is KUADCUGOGQASNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-8(2,11)6-3-4-7(9)10-5-6/h3-5,11H,1-2H3.
What are the key properties of 2-(6-fluoro-3-pyridinyl)propan-2-ol?
2-(6-fluoro-3-pyridinyl)propan-2-ol has a molecular weight of 155.17 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 69476595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).