1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone

C10H19NO2 — CID 63845115

IUPAC1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone
SMILESCOCCN1CCCC(C(C)=O)C1
InChIInChI=1S/C10H19NO2/c1-9(12)10-4-3-5-11(8-10)6-7-13-2/h10H,3-8H2,1-2H3
InChIKeyQEITXXIWCMHCIU-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.93
Rot. Bonds4

About 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone

1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone (PubChem CID 63845115) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone
PubChem CID63845115
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone
SMILESCOCCN1CCCC(C(C)=O)C1
InChIInChI=1S/C10H19NO2/c1-9(12)10-4-3-5-11(8-10)6-7-13-2/h10H,3-8H2,1-2H3
InChIKeyQEITXXIWCMHCIU-UHFFFAOYSA-N
XLogP0.93
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-(2-methoxyethyl)piperidine-3-carboxylic acid
CID 27440266
methyl 1-(2-methoxyethyl)piperidine-3-carboxylate
CID 78920456
1-(2-methoxyethyl)-N-methylpiperidine-3-carboxamide
CID 143767660
1-[1-[2-(2-methylpropoxy)ethyl]piperidin-3-yl]ethanone
CID 106452872
methyl 1-[2-(2-methoxyethoxy)ethyl]piperidine-3-carboxylate
CID 79884507
1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 75424732
(1S,5R)-3-[(3S)-1-(2-methoxyethyl)piperidine-3-carbonyl]-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 126423113
1-[1-(3-hydroxy-3-methylbutyl)piperidin-3-yl]ethanone
CID 79355581
1-[1-(2-methylsulfonylethyl)piperidin-3-yl]ethanone
CID 63847030
3-chloro-1-(2-methoxyethyl)piperidine
CID 63386779
methyl (3S)-1-(2-ethoxyethyl)piperidine-3-carboxylate
CID 79038653
2-(3-acetylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 63844591

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone?
The IUPAC name of 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone (CID 63845115) is 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone.
What is the SMILES notation for 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone?
The canonical SMILES for 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone is COCCN1CCCC(C(C)=O)C1.
What is the InChIKey of 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone?
The InChIKey is QEITXXIWCMHCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-9(12)10-4-3-5-11(8-10)6-7-13-2/h10H,3-8H2,1-2H3.
What are the key properties of 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone?
1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone has a molecular weight of 185.27 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone is sourced from PubChem (CID 63845115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).