phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol

C18H22N2O — CID 110906747

IUPACphenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
SMILESOC(c1ccccc1)C1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C18H22N2O/c21-18(15-6-2-1-3-7-15)16-9-12-20(13-10-16)14-17-8-4-5-11-19-17/h1-8,11,16,18,21H,9-10,12-14H2
InChIKeyFBNGYWBJZRXROV-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.03
Rot. Bonds4

About phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol

phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol (PubChem CID 110906747) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Namephenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
PubChem CID110906747
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Namephenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
SMILESOC(c1ccccc1)C1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C18H22N2O/c21-18(15-6-2-1-3-7-15)16-9-12-20(13-10-16)14-17-8-4-5-11-19-17/h1-8,11,16,18,21H,9-10,12-14H2
InChIKeyFBNGYWBJZRXROV-UHFFFAOYSA-N
XLogP3.03
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(1,2-oxazol-3-ylmethyl)piperidin-4-yl]-phenylmethanol
CID 111432875
N-[(1S)-1-phenylpropyl]-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 96531141
2-[(4-bromopiperidin-1-yl)methyl]pyridine
CID 80680400
1-[1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630112
[1-[(4-methyl-1,2,4-triazol-3-yl)methyl]piperidin-4-yl]-phenylmethanol
CID 110913167
[1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]-phenylmethanol
CID 139008684
[5-[[(3S)-3-[(S)-hydroxy(phenyl)methyl]cyclopentyl]methyl]-2-pyridinyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
CID 162137663
phenyl-[1-[(3-pyridin-4-ylphenyl)methyl]piperidin-4-yl]methanol
CID 75438511
phenyl-(1-prop-2-ynylpiperidin-4-yl)methanol
CID 110884402
1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethanol
CID 141230440
(R)-phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanol
CID 6604770
2-[[4-(trifluoromethyl)piperidin-1-yl]methyl]pyridine
CID 131703770

Frequently Asked Questions

What is the IUPAC name of phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol?
The IUPAC name of phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol (CID 110906747) is phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol.
What is the SMILES notation for phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol?
The canonical SMILES for phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol is OC(c1ccccc1)C1CCN(Cc2ccccn2)CC1.
What is the InChIKey of phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol?
The InChIKey is FBNGYWBJZRXROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c21-18(15-6-2-1-3-7-15)16-9-12-20(13-10-16)14-17-8-4-5-11-19-17/h1-8,11,16,18,21H,9-10,12-14H2.
What are the key properties of phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol?
phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol has a molecular weight of 282.39 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol is sourced from PubChem (CID 110906747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).