5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one

C16H24N2O3 — CID 70783689

IUPAC5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCOCCCC1CCCCN1C(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C16H24N2O3/c1-17-12-13(8-9-15(17)19)16(20)18-10-4-3-6-14(18)7-5-11-21-2/h8-9,12,14H,3-7,10-11H2,1-2H3
InChIKeyIWDZQKVYJMCUGT-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.81
Rot. Bonds5

About 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one

5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one (PubChem CID 70783689) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
PubChem CID70783689
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCOCCCC1CCCCN1C(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C16H24N2O3/c1-17-12-13(8-9-15(17)19)16(20)18-10-4-3-6-14(18)7-5-11-21-2/h8-9,12,14H,3-7,10-11H2,1-2H3
InChIKeyIWDZQKVYJMCUGT-UHFFFAOYSA-N
XLogP1.81
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-5-(2-methylpiperidine-1-carbonyl)pyridin-2-one
CID 45825163
3-chloro-5-{[2-(3-methoxypropyl)-1-piperidinyl]carbonyl}-2(1H)-pyridinone
CID 70705145
3-{[2-(3-methoxypropyl)-1-piperidinyl]carbonyl}-1,4,6-trimethyl-2(1H)-pyridinone
CID 70759441
3-chloro-5-[(2S)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 96359882
3-chloro-5-[(2R)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 96359884
3-[(2R)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1,4,6-trimethylpyridin-2-one
CID 97140093
3-[(2S)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1,4,6-trimethylpyridin-2-one
CID 97140094
5-[(2R)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 97153911
5-[(2S)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 97153912
5-(2,6-Dimethylpiperidine-1-carbonyl)-1-methylpyridin-2-one
CID 110693017
5-[2-(Hydroxymethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 110901892
6-isopropyl-5-{[2-(2-methoxyethyl)-1-piperidinyl]carbonyl}-2(1H)-pyridinone
CID 156585635

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The IUPAC name of 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one (CID 70783689) is 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one.
What is the SMILES notation for 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The canonical SMILES for 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one is COCCCC1CCCCN1C(=O)c1ccc(=O)n(C)c1.
What is the InChIKey of 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
The InChIKey is IWDZQKVYJMCUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-17-12-13(8-9-15(17)19)16(20)18-10-4-3-6-14(18)7-5-11-21-2/h8-9,12,14H,3-7,10-11H2,1-2H3.
What are the key properties of 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one?
5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one has a molecular weight of 292.38 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-methoxypropyl)piperidine-1-carbonyl]-1-methylpyridin-2-one is sourced from PubChem (CID 70783689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).