4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol

C17H19FN2O — CID 645747

IUPAC4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol
SMILESOC1(c2cccc(F)c2)CCN(Cc2ccncc2)CC1
InChIInChI=1S/C17H19FN2O/c18-16-3-1-2-15(12-16)17(21)6-10-20(11-7-17)13-14-4-8-19-9-5-14/h1-5,8-9,12,21H,6-7,10-11,13H2
InChIKeyQLBKAEXFISBJJQ-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.70
Rot. Bonds3

About 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol

4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol (PubChem CID 645747) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol
PubChem CID645747
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol
SMILESOC1(c2cccc(F)c2)CCN(Cc2ccncc2)CC1
InChIInChI=1S/C17H19FN2O/c18-16-3-1-2-15(12-16)17(21)6-10-20(11-7-17)13-14-4-8-19-9-5-14/h1-5,8-9,12,21H,6-7,10-11,13H2
InChIKeyQLBKAEXFISBJJQ-UHFFFAOYSA-N
XLogP2.70
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methoxyphenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol
CID 1446411
1-benzyl-4-(3,5-difluorophenyl)piperidin-4-ol
CID 139966182
1-[(3-fluorophenyl)methyl]-4-(pyridin-4-ylmethyl)piperazine
CID 828709
1-[(3-fluorophenyl)methyl]-4-(pyridin-4-ylmethyl)piperazine;oxalic acid
CID 163326429
1-benzyl-4-(4-fluorophenyl)piperidin-4-ol;hydrochloride
CID 71627119
2-(3-fluorophenyl)-N-[[(2R)-8-(pyridin-4-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]acetamide
CID 125161801
4-pyridin-3-yl-1-(pyridin-3-ylmethyl)piperidin-4-ol
CID 126470029
ethyl 4-[(3-fluorophenyl)methyl]-1-(pyridin-4-ylmethyl)piperidine-4-carboxylate
CID 42193901
4-(4-fluorophenyl)-1-[[2-(4-fluorophenyl)-4-pyridinyl]methyl]piperidin-4-ol
CID 19863535
3-fluoro-N-[2-[4-(3-fluorophenyl)-4-hydroxypiperidin-1-yl]ethyl]benzamide
CID 46965021
3-(3-fluoroanilino)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
CID 155875888
N-[1-benzyl-4-(3-fluorophenyl)piperidin-4-yl]acetamide
CID 68830269

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol?
The IUPAC name of 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol (CID 645747) is 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol?
The canonical SMILES for 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol is OC1(c2cccc(F)c2)CCN(Cc2ccncc2)CC1.
What is the InChIKey of 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol?
The InChIKey is QLBKAEXFISBJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c18-16-3-1-2-15(12-16)17(21)6-10-20(11-7-17)13-14-4-8-19-9-5-14/h1-5,8-9,12,21H,6-7,10-11,13H2.
What are the key properties of 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol?
4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol has a molecular weight of 286.35 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-1-(pyridin-4-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 645747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).