2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol

C15H17FN2O — CID 78928615

IUPAC2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC(C)c2ccccc2F)n1
InChIInChI=1S/C15H17FN2O/c1-10-7-8-15(19)14(18-10)9-17-11(2)12-5-3-4-6-13(12)16/h3-8,11,17,19H,9H2,1-2H3
InChIKeyXUFYNYRQVILLRM-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.09
Rot. Bonds4

About 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol

2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol (PubChem CID 78928615) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol
PubChem CID78928615
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC(C)c2ccccc2F)n1
InChIInChI=1S/C15H17FN2O/c1-10-7-8-15(19)14(18-10)9-17-11(2)12-5-3-4-6-13(12)16/h3-8,11,17,19H,9H2,1-2H3
InChIKeyXUFYNYRQVILLRM-UHFFFAOYSA-N
XLogP3.09
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol (CID 78928615) is 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol is Cc1ccc(O)c(CNC(C)c2ccccc2F)n1.
What is the InChIKey of 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol?
The InChIKey is XUFYNYRQVILLRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-10-7-8-15(19)14(18-10)9-17-11(2)12-5-3-4-6-13(12)16/h3-8,11,17,19H,9H2,1-2H3.
What are the key properties of 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol?
2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol has a molecular weight of 260.31 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-fluorophenyl)ethylamino]methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 78928615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).