5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one

C12H23NO3 — CID 116571064

IUPAC5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one
SMILESCOCCC(C)C(=O)COC1CCNCC1
InChIInChI=1S/C12H23NO3/c1-10(5-8-15-2)12(14)9-16-11-3-6-13-7-4-11/h10-11,13H,3-9H2,1-2H3
InChIKeyMWWAGLSXARWURO-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.00
Rot. Bonds7

About 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one

5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one (PubChem CID 116571064) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one.

Molecular Properties

Compound Name5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one
PubChem CID116571064
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one
SMILESCOCCC(C)C(=O)COC1CCNCC1
InChIInChI=1S/C12H23NO3/c1-10(5-8-15-2)12(14)9-16-11-3-6-13-7-4-11/h10-11,13H,3-9H2,1-2H3
InChIKeyMWWAGLSXARWURO-UHFFFAOYSA-N
XLogP1.00
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxybutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 64604853
6-methoxy-4-methyl-1-piperidin-4-ylhexan-3-one
CID 116563387
N-(1-methoxypropan-2-yl)-N-methyl-2-piperidin-4-yloxyacetamide
CID 63876735
N-methoxy-2-piperidin-4-yloxyacetamide
CID 64975041
N-(4-methoxybutyl)-2-piperidin-4-yloxyacetamide
CID 63875375
4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]piperidine;hydrochloride
CID 118540846
2-[2-methoxyethyl-(2-piperidin-4-yloxyacetyl)amino]acetic acid
CID 79271103
N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-piperidin-4-yloxyacetamide
CID 55252350
N-(3-methylbutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 61489309
N,N-dimethyl-2-piperidin-4-yloxyacetamide
CID 43346284
propyl 2-piperidin-4-yloxyacetate
CID 63871576
5-methoxy-5-oxo-2-[(2-piperidin-4-yloxyacetyl)amino]pentanoic acid
CID 82781715

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one?
The IUPAC name of 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one (CID 116571064) is 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one.
What is the SMILES notation for 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one?
The canonical SMILES for 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one is COCCC(C)C(=O)COC1CCNCC1.
What is the InChIKey of 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one?
The InChIKey is MWWAGLSXARWURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-10(5-8-15-2)12(14)9-16-11-3-6-13-7-4-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one?
5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one has a molecular weight of 229.32 g/mol, XLogP of 1.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-methyl-1-piperidin-4-yloxypentan-2-one is sourced from PubChem (CID 116571064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).