2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol

C11H12FNO — CID 90996519

IUPAC2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol
SMILESOC1CC=NC(c2ccc(F)cc2)C1
InChIInChI=1S/C11H12FNO/c12-9-3-1-8(2-4-9)11-7-10(14)5-6-13-11/h1-4,6,10-11,14H,5,7H2
InChIKeyCHEXBCOKLNBZHR-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.09
Rot. Bonds1

About 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol

2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol (PubChem CID 90996519) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol
PubChem CID90996519
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol
SMILESOC1CC=NC(c2ccc(F)cc2)C1
InChIInChI=1S/C11H12FNO/c12-9-3-1-8(2-4-9)11-7-10(14)5-6-13-11/h1-4,6,10-11,14H,5,7H2
InChIKeyCHEXBCOKLNBZHR-UHFFFAOYSA-N
XLogP2.09
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol?
The IUPAC name of 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol (CID 90996519) is 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol.
What is the SMILES notation for 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol?
The canonical SMILES for 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol is OC1CC=NC(c2ccc(F)cc2)C1.
What is the InChIKey of 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol?
The InChIKey is CHEXBCOKLNBZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c12-9-3-1-8(2-4-9)11-7-10(14)5-6-13-11/h1-4,6,10-11,14H,5,7H2.
What are the key properties of 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol?
2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol has a molecular weight of 193.22 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2,3,4,5-tetrahydropyridin-4-ol is sourced from PubChem (CID 90996519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).