3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one

C15H25N3O2 — CID 82144429

IUPAC3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one
SMILESCN(C)CCCOc1cccn(C2CCNCC2)c1=O
InChIInChI=1S/C15H25N3O2/c1-17(2)10-4-12-20-14-5-3-11-18(15(14)19)13-6-8-16-9-7-13/h3,5,11,13,16H,4,6-10,12H2,1-2H3
InChIKeySLIZWHIVBKKEMQ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.10
Rot. Bonds6

About 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one

3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one (PubChem CID 82144429) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one.

Molecular Properties

Compound Name3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one
PubChem CID82144429
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one
SMILESCN(C)CCCOc1cccn(C2CCNCC2)c1=O
InChIInChI=1S/C15H25N3O2/c1-17(2)10-4-12-20-14-5-3-11-18(15(14)19)13-6-8-16-9-7-13/h3,5,11,13,16H,4,6-10,12H2,1-2H3
InChIKeySLIZWHIVBKKEMQ-UHFFFAOYSA-N
XLogP1.10
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[3-(dimethylamino)propoxy]-1-(piperidin-4-ylmethyl)pyridin-2-one
CID 82151025
2-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)oxy]acetamide
CID 82144396
N-(2-methoxyethyl)-N-methyl-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715240
1-(4-aminobutyl)-3-[2-(dimethylamino)ethoxy]pyridin-2-one
CID 82143334
(2S)-N-[3-(2-chlorophenoxy)propyl]-N-methyl-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 86284149
N-cyclopropyl-N-(2-methoxyethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715573
N-methyl-N-pentan-3-yl-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62717118
N,N-dimethyl-2-[2-[4-(piperidin-4-ylmethyl)piperazin-1-yl]phenoxy]ethanamine
CID 120848506
4-[[3-[2-(dimethylamino)ethoxy]-2-oxo-1-pyridinyl]methyl]benzonitrile
CID 82150670
3-[methyl-(1-piperidin-4-ylpyrrole-2-carbonyl)amino]propanoic acid
CID 62715589
1-[2-[3-(dimethylamino)propoxy]phenyl]piperidin-4-amine
CID 114526497
N-[3-[3-(dimethylamino)propoxy]phenyl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119885815

Frequently Asked Questions

What is the IUPAC name of 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one?
The IUPAC name of 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one (CID 82144429) is 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one.
What is the SMILES notation for 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one?
The canonical SMILES for 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one is CN(C)CCCOc1cccn(C2CCNCC2)c1=O.
What is the InChIKey of 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one?
The InChIKey is SLIZWHIVBKKEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-17(2)10-4-12-20-14-5-3-11-18(15(14)19)13-6-8-16-9-7-13/h3,5,11,13,16H,4,6-10,12H2,1-2H3.
What are the key properties of 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one?
3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one has a molecular weight of 279.38 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(dimethylamino)propoxy]-1-piperidin-4-ylpyridin-2-one is sourced from PubChem (CID 82144429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).