(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol

C8H10FNO2 — CID 58201187

IUPAC(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol
SMILESCOc1c(F)cnc(CO)c1C
InChIInChI=1S/C8H10FNO2/c1-5-7(4-11)10-3-6(9)8(5)12-2/h3,11H,4H2,1-2H3
InChIKeyGEJKWNIUEGBHFO-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.03
Rot. Bonds2

About (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol

(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol (PubChem CID 58201187) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol
PubChem CID58201187
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol
SMILESCOc1c(F)cnc(CO)c1C
InChIInChI=1S/C8H10FNO2/c1-5-7(4-11)10-3-6(9)8(5)12-2/h3,11H,4H2,1-2H3
InChIKeyGEJKWNIUEGBHFO-UHFFFAOYSA-N
XLogP1.03
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol?
The IUPAC name of (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol (CID 58201187) is (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol.
What is the SMILES notation for (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol?
The canonical SMILES for (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol is COc1c(F)cnc(CO)c1C.
What is the InChIKey of (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol?
The InChIKey is GEJKWNIUEGBHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-5-7(4-11)10-3-6(9)8(5)12-2/h3,11H,4H2,1-2H3.
What are the key properties of (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol?
(5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol has a molecular weight of 171.17 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-4-methoxy-3-methyl-2-pyridinyl)methanol is sourced from PubChem (CID 58201187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).