4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one

C14H20N2O3 — CID 62358122

IUPAC4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCn1ccc(C(=O)N2CCCC(CCO)C2)cc1=O
InChIInChI=1S/C14H20N2O3/c1-15-7-4-12(9-13(15)18)14(19)16-6-2-3-11(10-16)5-8-17/h4,7,9,11,17H,2-3,5-6,8,10H2,1H3
InChIKeyGJIPRSVWAPWAIX-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.62
Rot. Bonds3

About 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one

4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one (PubChem CID 62358122) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one.

Molecular Properties

Compound Name4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
PubChem CID62358122
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCn1ccc(C(=O)N2CCCC(CCO)C2)cc1=O
InChIInChI=1S/C14H20N2O3/c1-15-7-4-12(9-13(15)18)14(19)16-6-2-3-11(10-16)5-8-17/h4,7,9,11,17H,2-3,5-6,8,10H2,1H3
InChIKeyGJIPRSVWAPWAIX-UHFFFAOYSA-N
XLogP0.62
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The IUPAC name of 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one (CID 62358122) is 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one.
What is the SMILES notation for 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The canonical SMILES for 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one is Cn1ccc(C(=O)N2CCCC(CCO)C2)cc1=O.
What is the InChIKey of 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The InChIKey is GJIPRSVWAPWAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-15-7-4-12(9-13(15)18)14(19)16-6-2-3-11(10-16)5-8-17/h4,7,9,11,17H,2-3,5-6,8,10H2,1H3.
What are the key properties of 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one has a molecular weight of 264.32 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one is sourced from PubChem (CID 62358122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).