2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol

C12H10ClFN2O — CID 164546065

IUPAC2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol
SMILESCc1cc(-c2cc(Cl)ccc2F)nc(N)c1O
InChIInChI=1S/C12H10ClFN2O/c1-6-4-10(16-12(15)11(6)17)8-5-7(13)2-3-9(8)14/h2-5,17H,1H3,(H2,15,16)
InChIKeyUFKLNOFWHMDUKE-UHFFFAOYSA-N
MW252.68 g/mol
LogP3.14
Rot. Bonds1

About 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol

2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol (PubChem CID 164546065) has the molecular formula C12H10ClFN2O and a molecular weight of 252.68 g/mol. Its IUPAC name is 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol.

Molecular Properties

Compound Name2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol
PubChem CID164546065
Molecular FormulaC12H10ClFN2O
Molecular Weight252.68 g/mol
Exact Mass252.05
IUPAC Name2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol
SMILESCc1cc(-c2cc(Cl)ccc2F)nc(N)c1O
InChIInChI=1S/C12H10ClFN2O/c1-6-4-10(16-12(15)11(6)17)8-5-7(13)2-3-9(8)14/h2-5,17H,1H3,(H2,15,16)
InChIKeyUFKLNOFWHMDUKE-UHFFFAOYSA-N
XLogP3.14
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.68
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol?
The IUPAC name of 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol (CID 164546065) is 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol.
What is the SMILES notation for 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol?
The canonical SMILES for 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol is Cc1cc(-c2cc(Cl)ccc2F)nc(N)c1O.
What is the InChIKey of 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol?
The InChIKey is UFKLNOFWHMDUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2O/c1-6-4-10(16-12(15)11(6)17)8-5-7(13)2-3-9(8)14/h2-5,17H,1H3,(H2,15,16).
What are the key properties of 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol?
2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol has a molecular weight of 252.68 g/mol, XLogP of 3.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(5-chloro-2-fluorophenyl)-4-methylpyridin-3-ol is sourced from PubChem (CID 164546065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).