1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol

C13H14FNO — CID 141203487

IUPAC1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol
SMILESCC1=CC(O)=CCN1Cc1cccc(F)c1
InChIInChI=1S/C13H14FNO/c1-10-7-13(16)5-6-15(10)9-11-3-2-4-12(14)8-11/h2-5,7-8,16H,6,9H2,1H3
InChIKeyNQLUZWRBCYCAFO-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.99
Rot. Bonds2

About 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol

1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol (PubChem CID 141203487) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol.

Molecular Properties

Compound Name1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol
PubChem CID141203487
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol
SMILESCC1=CC(O)=CCN1Cc1cccc(F)c1
InChIInChI=1S/C13H14FNO/c1-10-7-13(16)5-6-15(10)9-11-3-2-4-12(14)8-11/h2-5,7-8,16H,6,9H2,1H3
InChIKeyNQLUZWRBCYCAFO-UHFFFAOYSA-N
XLogP2.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-benzyl-4-[(3-fluorophenyl)methyl]piperazine
CID 764596
1-[(3-fluorophenyl)methyl]-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazine
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7-[(3-fluorophenyl)methyl]-5,6-dihydro-2H-[1,2,4]triazolo[4,3-a]pyrazine-3,8-dione
CID 75466407
(3S)-1-benzyl-4-[(3-fluorophenyl)methyl]-3-methylpiperazine-2,5-dione
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CID 53013550

Frequently Asked Questions

What is the IUPAC name of 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol?
The IUPAC name of 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol (CID 141203487) is 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol.
What is the SMILES notation for 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol?
The canonical SMILES for 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol is CC1=CC(O)=CCN1Cc1cccc(F)c1.
What is the InChIKey of 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol?
The InChIKey is NQLUZWRBCYCAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c1-10-7-13(16)5-6-15(10)9-11-3-2-4-12(14)8-11/h2-5,7-8,16H,6,9H2,1H3.
What are the key properties of 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol?
1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol has a molecular weight of 219.26 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-fluorophenyl)methyl]-6-methyl-2H-pyridin-4-ol is sourced from PubChem (CID 141203487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).