2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride

C11H23ClN2O2 — CID 119675101

IUPAC2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride
SMILESCOCCNCC(=O)N1CCC(C)CC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-10-3-6-13(7-4-10)11(14)9-12-5-8-15-2;/h10,12H,3-9H2,1-2H3;1H
InChIKeyHQTYSTRVMLOMQP-UHFFFAOYSA-N
MW250.77 g/mol
LogP0.90
Rot. Bonds5

About 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride

2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride (PubChem CID 119675101) has the molecular formula C11H23ClN2O2 and a molecular weight of 250.77 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride
PubChem CID119675101
Molecular FormulaC11H23ClN2O2
Molecular Weight250.77 g/mol
Exact Mass250.14
IUPAC Name2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride
SMILESCOCCNCC(=O)N1CCC(C)CC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-10-3-6-13(7-4-10)11(14)9-12-5-8-15-2;/h10,12H,3-9H2,1-2H3;1H
InChIKeyHQTYSTRVMLOMQP-UHFFFAOYSA-N
XLogP0.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2-methoxyethylamino)acetyl]piperidine-4-carboxylic acid
CID 79280780
1-(4-tert-butylpiperidin-1-yl)-2-(2-methoxyethylamino)ethanone
CID 79280949
1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 107217441
2-(2-methoxyethylamino)-1-(3-methoxypyrrolidin-1-yl)ethanone
CID 103532856
1-[3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 79281115
1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 112625104
1-cyclohexyl-3-[1-[2-(2-methoxyethylamino)acetyl]piperidin-4-yl]urea
CID 119750507
1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-(2-methoxyethylamino)ethanone
CID 78914134
2-(2-methoxyethylamino)-1-[4-(4-propan-2-ylcyclohexyl)piperazin-1-yl]ethanone;dihydrochloride
CID 119896929
1-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 119836738
2-(2-methoxyethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]acetamide;dihydrochloride
CID 119866597
1-(4-acetyl-1,4-diazepan-1-yl)-2-(2-methoxyethylamino)ethanone
CID 79281707

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride (CID 119675101) is 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride is COCCNCC(=O)N1CCC(C)CC1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride?
The InChIKey is HQTYSTRVMLOMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2.ClH/c1-10-3-6-13(7-4-10)11(14)9-12-5-8-15-2;/h10,12H,3-9H2,1-2H3;1H.
What are the key properties of 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride?
2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride has a molecular weight of 250.77 g/mol, XLogP of 0.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-1-(4-methylpiperidin-1-yl)ethanone;hydrochloride is sourced from PubChem (CID 119675101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).