4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol

C19H23FN2O2 — CID 56705612

IUPAC4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
SMILESCc1ncc(CO)c(CN2CCCCC2c2ccc(F)cc2)c1O
InChIInChI=1S/C19H23FN2O2/c1-13-19(24)17(15(12-23)10-21-13)11-22-9-3-2-4-18(22)14-5-7-16(20)8-6-14/h5-8,10,18,23-24H,2-4,9,11-12H2,1H3
InChIKeyKWUWWQLMNYPNPV-UHFFFAOYSA-N
MW330.40 g/mol
LogP3.45
Rot. Bonds4

About 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol

4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol (PubChem CID 56705612) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol.

Molecular Properties

Compound Name4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
PubChem CID56705612
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC Name4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
SMILESCc1ncc(CO)c(CN2CCCCC2c2ccc(F)cc2)c1O
InChIInChI=1S/C19H23FN2O2/c1-13-19(24)17(15(12-23)10-21-13)11-22-9-3-2-4-18(22)14-5-7-16(20)8-6-14/h5-8,10,18,23-24H,2-4,9,11-12H2,1H3
InChIKeyKWUWWQLMNYPNPV-UHFFFAOYSA-N
XLogP3.45
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-3,5-dimethyl-1,2-oxazole
CID 94616382
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;ethanol
CID 68776255
4-[[(2-hydroxycyclohexyl)amino]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 116686378
2-(4-fluorophenyl)-1-(2-methylpropyl)azepane
CID 90816221
2-[[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 99947605
5-(hydroxymethyl)-4-[[(4S)-4-(3-hydroxyphenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methyl]-2-methylpyridin-3-ol
CID 95226886
2-(4-fluorophenyl)-1-propylpyrrolidine
CID 102544448
3-ethyl-5-[[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-1H-1,2,4-triazole
CID 124756604
N-[(4-fluorophenyl)methyl]-2-[(2S)-1-[(4-fluorophenyl)methyl]piperidin-2-yl]-4-methylpyrimidine-5-carboxamide
CID 92639751
N-[(4-fluorophenyl)methyl]-2-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]-4-methylpyrimidine-5-carboxamide
CID 110247725
2-(1,5-dimethylpyrrol-2-yl)-5-[[(2R)-2-(4-fluorophenyl)piperidin-1-yl]methyl]-1,3,4-oxadiazole
CID 95730501
5-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-N,N-dimethylfuran-2-carboxamide
CID 56899649

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol?
The IUPAC name of 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol (CID 56705612) is 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol.
What is the SMILES notation for 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol?
The canonical SMILES for 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol is Cc1ncc(CO)c(CN2CCCCC2c2ccc(F)cc2)c1O.
What is the InChIKey of 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol?
The InChIKey is KWUWWQLMNYPNPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-13-19(24)17(15(12-23)10-21-13)11-22-9-3-2-4-18(22)14-5-7-16(20)8-6-14/h5-8,10,18,23-24H,2-4,9,11-12H2,1H3.
What are the key properties of 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol?
4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol has a molecular weight of 330.40 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol is sourced from PubChem (CID 56705612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).