1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride

C11H23ClN2O2 — CID 146064318

IUPAC1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride
SMILESCNCC(=O)N1CCC(CCOC)CC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2;/h10,12H,3-9H2,1-2H3;1H
InChIKeyJHXMPGILNMTMMH-UHFFFAOYSA-N
MW250.77 g/mol
LogP0.90
Rot. Bonds5

About 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride

1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride (PubChem CID 146064318) has the molecular formula C11H23ClN2O2 and a molecular weight of 250.77 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride
PubChem CID146064318
Molecular FormulaC11H23ClN2O2
Molecular Weight250.77 g/mol
Exact Mass250.14
IUPAC Name1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride
SMILESCNCC(=O)N1CCC(CCOC)CC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2;/h10,12H,3-9H2,1-2H3;1H
InChIKeyJHXMPGILNMTMMH-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

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Related Compounds

1-[4-(methoxymethyl)piperidin-1-yl]-2-(methylamino)ethanone
CID 63977470
1-(4-ethylpiperidin-1-yl)-2-(methylamino)ethanone
CID 60963767
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-(methylamino)ethanone;dihydrochloride
CID 119852035
1-[4-(2-methoxyethyl)piperidin-1-yl]pentan-1-one
CID 90437878
1-[4-(1-methoxypropan-2-yl)piperidin-1-yl]-2-(methylamino)ethanone
CID 56881213
1-(4-tert-butylpiperidin-1-yl)-2-(methylamino)ethanone;hydrochloride
CID 119762682
6-[1-[2-(methylamino)acetyl]piperidin-4-yl]hexan-2-one
CID 164535566
1-[4-(2-methoxyacetyl)piperazin-1-yl]-2-(methylamino)ethanone
CID 60947029
2-(methylamino)-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 59542495
1-[4-(3-methoxypropylsulfonyl)piperazin-1-yl]-2-(methylamino)ethanone;hydrochloride
CID 120705193
1-(4-tert-butylpiperidin-1-yl)-2-(2-methoxyethylamino)ethanone
CID 79280949
1-(4-ethylpiperazin-1-yl)-2-[1-[2-(methylamino)acetyl]piperidin-4-yl]ethanone;hydrochloride
CID 120704431

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride?
The IUPAC name of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride (CID 146064318) is 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride.
What is the SMILES notation for 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride?
The canonical SMILES for 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride is CNCC(=O)N1CCC(CCOC)CC1.Cl.
What is the InChIKey of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride?
The InChIKey is JHXMPGILNMTMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2.ClH/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2;/h10,12H,3-9H2,1-2H3;1H.
What are the key properties of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride?
1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)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 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride is sourced from PubChem (CID 146064318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).