5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one

C13H18N2O3 — CID 55064660

IUPAC5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCCC(CCO)C1
InChIInChI=1S/C13H18N2O3/c16-7-5-10-2-1-6-15(9-10)13(18)11-3-4-12(17)14-8-11/h3-4,8,10,16H,1-2,5-7,9H2,(H,14,17)
InChIKeyPLNPZSKAGNDHEH-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.61
Rot. Bonds3

About 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one

5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 55064660) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID55064660
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCCC(CCO)C1
InChIInChI=1S/C13H18N2O3/c16-7-5-10-2-1-6-15(9-10)13(18)11-3-4-12(17)14-8-11/h3-4,8,10,16H,1-2,5-7,9H2,(H,14,17)
InChIKeyPLNPZSKAGNDHEH-UHFFFAOYSA-N
XLogP0.61
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]benzenecarbothioamide
CID 107227391
5-[(3R)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 95550119
(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 28826297
[3-(2-hydroxyethyl)piperidin-1-yl]-(4-hydroxy-3-methylphenyl)methanone
CID 103957620
(3-chloro-4-hydroxyphenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62371633
(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62372685
5-(3-pyrrolidin-3-ylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 167899187
(3,5-dibromophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 103909359
[3-(2-hydroxyethyl)piperidin-1-yl]-pyrimidin-5-ylmethanone
CID 113434939
(4-chloro-3-methylphenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 112706030
(3-bromo-4-fluorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 103855477
[3-(2-hydroxyethyl)piperidin-1-yl]-(3,4,5-trifluorophenyl)methanone
CID 63186795

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 55064660) is 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one is O=C(c1ccc(=O)[nH]c1)N1CCCC(CCO)C1.
What is the InChIKey of 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is PLNPZSKAGNDHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-7-5-10-2-1-6-15(9-10)13(18)11-3-4-12(17)14-8-11/h3-4,8,10,16H,1-2,5-7,9H2,(H,14,17).
What are the key properties of 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 250.30 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 55064660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).