ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one

C12H25NO2 — CID 142537667

IUPACethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one
SMILESCC.CCC1CCN(CCOC)C(=O)C1
InChIInChI=1S/C10H19NO2.C2H6/c1-3-9-4-5-11(6-7-13-2)10(12)8-9;1-2/h9H,3-8H2,1-2H3;1-2H3
InChIKeyRKOFXAZEVHUAMK-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.31
Rot. Bonds4

About ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one

ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one (PubChem CID 142537667) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one.

Molecular Properties

Compound Nameethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one
PubChem CID142537667
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Nameethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one
SMILESCC.CCC1CCN(CCOC)C(=O)C1
InChIInChI=1S/C10H19NO2.C2H6/c1-3-9-4-5-11(6-7-13-2)10(12)8-9;1-2/h9H,3-8H2,1-2H3;1-2H3
InChIKeyRKOFXAZEVHUAMK-UHFFFAOYSA-N
XLogP2.31
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;4-ethyl-1-(2-methoxyethyl)piperidine
CID 177021605
1-(2-methoxyethyl)-4-methylpyrrolidin-2-one
CID 89120787
4-(chloromethyl)-1-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyrrolidin-2-one
CID 168506657
1-cyclopropyl-4-ethylpiperidin-2-one
CID 153405056
3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid
CID 112514282
1-(2-methoxyethyl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711430
1-(cyclohexylmethyl)-4-(2-methoxyethyl)-1,4-diazepan-5-one
CID 26316520
4-[(3,5-dimethylphenyl)methyl]-1-(2-methoxyethyl)pyrrolidin-2-one
CID 91828980
1-(2-methoxyethyl)-4-(piperidin-4-ylmethyl)piperazine-2,3-dione
CID 83290625
ethane;4-ethyl-1-[1-(2-methoxyethyl)piperidin-4-yl]piperidine
CID 170586343
1-(2-methoxyethyl)-4-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyrrolidin-2-one
CID 91832320
(3R)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylate
CID 7061674

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one?
The IUPAC name of ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one (CID 142537667) is ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one.
What is the SMILES notation for ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one?
The canonical SMILES for ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one is CC.CCC1CCN(CCOC)C(=O)C1.
What is the InChIKey of ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one?
The InChIKey is RKOFXAZEVHUAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.C2H6/c1-3-9-4-5-11(6-7-13-2)10(12)8-9;1-2/h9H,3-8H2,1-2H3;1-2H3.
What are the key properties of ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one?
ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one has a molecular weight of 215.34 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-1-(2-methoxyethyl)piperidin-2-one is sourced from PubChem (CID 142537667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).