5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one

C17H18N2O4 — CID 71799585

IUPAC5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one
SMILESCc1cccc(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)n1
InChIInChI=1S/C17H18N2O4/c1-12-3-2-4-15(18-12)23-14-7-9-19(10-8-14)17(21)13-5-6-16(20)22-11-13/h2-6,11,14H,7-10H2,1H3
InChIKeyZNRFKLODKJRWND-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.03
Rot. Bonds3

About 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one

5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one (PubChem CID 71799585) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one.

Molecular Properties

Compound Name5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one
PubChem CID71799585
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one
SMILESCc1cccc(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)n1
InChIInChI=1S/C17H18N2O4/c1-12-3-2-4-15(18-12)23-14-7-9-19(10-8-14)17(21)13-5-6-16(20)22-11-13/h2-6,11,14H,7-10H2,1H3
InChIKeyZNRFKLODKJRWND-UHFFFAOYSA-N
XLogP2.03
TPSA72.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tert-butyl 4-[4-[[5-(dimethylcarbamoyl)-6-methyl-2-pyridinyl]oxy]cyclohexyl]oxypiperidine-1-carboxylate
CID 53492593
1-[(3S)-3-[4-(aminomethyl)-6-(trifluoromethyl)pyridin-2-yl]oxypiperidin-1-yl]-2-methylpropan-1-one;2,2,2-trifluoroacetic acid
CID 132253134
US10030012, Example 72
CID 78318317
US11045457, Example 83
CID 146402335
2-(2-Fluorophenoxy)-1-(4-((6-methylpyridin-2-yl)oxy)piperidin-1-yl)ethanone
CID 71799565
2-(4-Fluorophenyl)-1-(4-((6-methylpyridin-2-yl)oxy)piperidin-1-yl)ethanone
CID 71799566
1-[4-(6-Phenoxypyridin-2-YL)piperidin-1-YL]ethanone
CID 95821984
[2-methyl-1-[(3S)-3-[(6-methyl-2-pyridinyl)oxy]pyrrolidin-1-yl]-1-oxopropan-2-yl] acetate
CID 129416639
2-Ethoxy-1-(4-((6-methylpyridin-2-yl)oxy)piperidin-1-yl)ethanone
CID 71799552
Ethyl 4-(4-((6-methylpyridin-2-yl)oxy)piperidin-1-yl)-4-oxobutanoate
CID 71799553
(2-Ethoxyphenyl)(4-((6-methylpyridin-2-yl)oxy)piperidin-1-yl)methanone
CID 71799554
Ethyl 4-[(6-methylpyridin-2-YL)oxy]piperidine-1-carboxylate
CID 71799576

Frequently Asked Questions

What is the IUPAC name of 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one?
The IUPAC name of 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one (CID 71799585) is 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one.
What is the SMILES notation for 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one?
The canonical SMILES for 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one is Cc1cccc(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)n1.
What is the InChIKey of 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one?
The InChIKey is ZNRFKLODKJRWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-12-3-2-4-15(18-12)23-14-7-9-19(10-8-14)17(21)13-5-6-16(20)22-11-13/h2-6,11,14H,7-10H2,1H3.
What are the key properties of 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one?
5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one has a molecular weight of 314.34 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one is sourced from PubChem (CID 71799585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).