2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol

C14H15FN2O — CID 114833173

IUPAC2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1cnccc1N
InChIInChI=1S/C14H15FN2O/c1-14(18,12-9-17-7-6-13(12)16)8-10-2-4-11(15)5-3-10/h2-7,9,18H,8H2,1H3,(H2,16,17)
InChIKeyHBYOHFDAGBPFOZ-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.25
Rot. Bonds3

About 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol

2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol (PubChem CID 114833173) has the molecular formula C14H15FN2O and a molecular weight of 246.29 g/mol. Its IUPAC name is 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
PubChem CID114833173
Molecular FormulaC14H15FN2O
Molecular Weight246.29 g/mol
Exact Mass246.12
IUPAC Name2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1cnccc1N
InChIInChI=1S/C14H15FN2O/c1-14(18,12-9-17-7-6-13(12)16)8-10-2-4-11(15)5-3-10/h2-7,9,18H,8H2,1H3,(H2,16,17)
InChIKeyHBYOHFDAGBPFOZ-UHFFFAOYSA-N
XLogP2.25
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-2-(3-fluoro-4-pyridinyl)propan-2-ol
CID 114832951
2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833119
1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
CID 114833720
1-(4-tert-butylphenyl)-2-(4-fluorophenyl)propan-2-ol
CID 65144980
1-(4-fluorophenyl)-2-phenylpropan-2-ol
CID 53329553
2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833204
2-(2-amino-5-fluorophenyl)-2-methyl-3-pyridin-4-ylpropanoic acid
CID 117048965
1-(4-amino-3-pyridinyl)-3-(4-fluorophenyl)-3-methylbutan-2-one
CID 64759762
1-(4-fluorophenyl)-2,3-dimethylbutan-2-ol
CID 58481762
1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol
CID 66271911
3-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide
CID 114834276
4-amino-2-(3-fluoro-4-pyridinyl)butan-2-ol
CID 104739345

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The IUPAC name of 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol (CID 114833173) is 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol.
What is the SMILES notation for 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The canonical SMILES for 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol is CC(O)(Cc1ccc(F)cc1)c1cnccc1N.
What is the InChIKey of 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The InChIKey is HBYOHFDAGBPFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-14(18,12-9-17-7-6-13(12)16)8-10-2-4-11(15)5-3-10/h2-7,9,18H,8H2,1H3,(H2,16,17).
What are the key properties of 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol has a molecular weight of 246.29 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol is sourced from PubChem (CID 114833173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).