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

C18H22N2O2 — CID 649162

IUPAC4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol
SMILESCOc1ccc(C2CCN(Cc3cccnc3)CC2O)cc1
InChIInChI=1S/C18H22N2O2/c1-22-16-6-4-15(5-7-16)17-8-10-20(13-18(17)21)12-14-3-2-9-19-11-14/h2-7,9,11,17-18,21H,8,10,12-13H2,1H3
InChIKeyKJVSEDNCGBHECA-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.44
Rot. Bonds4

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

4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol (PubChem CID 649162) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol
PubChem CID649162
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol
SMILESCOc1ccc(C2CCN(Cc3cccnc3)CC2O)cc1
InChIInChI=1S/C18H22N2O2/c1-22-16-6-4-15(5-7-16)17-8-10-20(13-18(17)21)12-14-3-2-9-19-11-14/h2-7,9,11,17-18,21H,8,10,12-13H2,1H3
InChIKeyKJVSEDNCGBHECA-UHFFFAOYSA-N
XLogP2.44
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R,4R)-1-benzyl-4-(4-methoxyphenyl)piperidin-3-ol
CID 118207526
2-(4-methoxyphenyl)-1-methyl-4-(pyridin-3-ylmethyl)piperazine
CID 110098244
methyl (3S)-1-(pyridin-3-ylmethyl)pyrrolidine-3-carboxylate
CID 142605380
3-ethyl-1-(pyridin-3-ylmethyl)piperidin-4-ol
CID 114510870
4-(4-methoxyphenyl)-1-prop-2-ynylpiperidin-3-ol
CID 3231134
2-(4-methoxyphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]acetamide
CID 16895811
(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
CID 54282589
1-benzyl-4-(3-hydroxyphenyl)piperidin-3-ol;1-benzyl-4-(3-methoxyphenyl)piperidin-3-ol
CID 161060195
(3S,4R)-4-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-3-carboxylic acid
CID 70738871
1-[(3S)-3-(4-methoxyphenyl)-4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanone
CID 124947507
3-[[3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrrolidin-1-yl]methyl]pyridine
CID 91916522
(3S,4S)-1-[(2-methoxy-4-pyridinyl)methyl]-4-phenylpiperidin-3-ol
CID 163309012

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol?
The IUPAC name of 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol (CID 649162) is 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol?
The canonical SMILES for 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol is COc1ccc(C2CCN(Cc3cccnc3)CC2O)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol?
The InChIKey is KJVSEDNCGBHECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-22-16-6-4-15(5-7-16)17-8-10-20(13-18(17)21)12-14-3-2-9-19-11-14/h2-7,9,11,17-18,21H,8,10,12-13H2,1H3.
What are the key properties of 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol?
4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol has a molecular weight of 298.39 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 649162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).