(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone

C17H18N2O2 — CID 63859040

IUPAC(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cncc(O)c1)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C17H18N2O2/c20-16-10-15(11-18-12-16)17(21)19-8-6-14(7-9-19)13-4-2-1-3-5-13/h1-5,10-12,14,20H,6-9H2
InChIKeyAOBKHWQGLQVZBD-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.81
Rot. Bonds2

About (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone

(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone (PubChem CID 63859040) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone
PubChem CID63859040
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cncc(O)c1)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C17H18N2O2/c20-16-10-15(11-18-12-16)17(21)19-8-6-14(7-9-19)13-4-2-1-3-5-13/h1-5,10-12,14,20H,6-9H2
InChIKeyAOBKHWQGLQVZBD-UHFFFAOYSA-N
XLogP2.81
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2-phenylethenyl)-3-pyridinyl]-(4-phenylpiperidin-1-yl)methanone
CID 174395737
1-(5-hydroxypyridine-3-carbonyl)piperidine-4-carboxylic acid
CID 63850646
(5-hydroxy-3-pyridinyl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103711801
3,9-diazabicyclo[4.2.1]nonan-3-yl-(5-hydroxy-3-pyridinyl)methanone
CID 115313946
[4-[(dimethylamino)methyl]piperidin-1-yl]-(5-hydroxy-3-pyridinyl)methanone
CID 63859263
(3-fluoro-4-hydroxyphenyl)-(4-phenylpiperidin-1-yl)methanone
CID 146427603
[3,5-bis(trifluoromethyl)phenyl]-(4-phenylpiperidin-1-yl)methanone
CID 44765726
(5-hydroxy-3-pyridinyl)-(4-methylpiperazin-1-yl)methanone
CID 63864754
[3-(dimethylamino)pyrrolidin-1-yl]-(5-hydroxy-3-pyridinyl)methanone
CID 63858593
(5-bromothiophen-3-yl)-(4-phenylpiperidin-1-yl)methanone
CID 39581702
[4-(2-hydroxyethoxy)piperidin-1-yl]-(5-hydroxy-3-pyridinyl)methanone
CID 82691397
[1-(6-chloropyridine-3-carbonyl)piperidin-4-yl]-(4-phenylpiperidin-1-yl)methanone
CID 134799605

Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone?
The IUPAC name of (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone (CID 63859040) is (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone is O=C(c1cncc(O)c1)N1CCC(c2ccccc2)CC1.
What is the InChIKey of (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone?
The InChIKey is AOBKHWQGLQVZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-16-10-15(11-18-12-16)17(21)19-8-6-14(7-9-19)13-4-2-1-3-5-13/h1-5,10-12,14,20H,6-9H2.
What are the key properties of (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone?
(5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone has a molecular weight of 282.34 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-3-pyridinyl)-(4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 63859040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).