N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride

C13H29Cl2N3O2 — CID 119871091

IUPACN-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride
SMILESCOCCN(C)CCNC(=O)CC1CCNCC1.Cl.Cl
InChIInChI=1S/C13H27N3O2.2ClH/c1-16(9-10-18-2)8-7-15-13(17)11-12-3-5-14-6-4-12;;/h12,14H,3-11H2,1-2H3,(H,15,17);2*1H
InChIKeyQERZJNKDCGBITC-UHFFFAOYSA-N
MW330.30 g/mol
LogP0.91
Rot. Bonds8

About N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride

N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride (PubChem CID 119871091) has the molecular formula C13H29Cl2N3O2 and a molecular weight of 330.30 g/mol. Its IUPAC name is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride
PubChem CID119871091
Molecular FormulaC13H29Cl2N3O2
Molecular Weight330.30 g/mol
Exact Mass329.16
IUPAC NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride
SMILESCOCCN(C)CCNC(=O)CC1CCNCC1.Cl.Cl
InChIInChI=1S/C13H27N3O2.2ClH/c1-16(9-10-18-2)8-7-15-13(17)11-12-3-5-14-6-4-12;;/h12,14H,3-11H2,1-2H3,(H,15,17);2*1H
InChIKeyQERZJNKDCGBITC-UHFFFAOYSA-N
XLogP0.91
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.30
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-aminocyclohexyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]acetamide
CID 62849411
N-(5-methoxypentyl)-2-pyrrolidin-3-ylacetamide
CID 104954739
N-[2-(N-methylanilino)ethyl]-2-piperidin-4-ylacetamide
CID 61260106
N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
CID 24707221
N-(2-methoxyethyl)-2-(piperidin-4-ylmethylsulfonyl)acetamide
CID 82181995
2-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120799495
N-[2-[2-methoxyethyl(methyl)amino]ethyl]azepane-2-carboxamide
CID 64570141
2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 64609560
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(prop-2-ynylamino)acetamide
CID 79271047
N-[2-(4-methoxyphenyl)ethyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 119673168
N-[2-[2-methoxyethyl(methyl)amino]ethyl]morpholine-2-carboxamide
CID 62842960
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
CID 63129598

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride?
The IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride (CID 119871091) is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride.
What is the SMILES notation for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride?
The canonical SMILES for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride is COCCN(C)CCNC(=O)CC1CCNCC1.Cl.Cl.
What is the InChIKey of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride?
The InChIKey is QERZJNKDCGBITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2.2ClH/c1-16(9-10-18-2)8-7-15-13(17)11-12-3-5-14-6-4-12;;/h12,14H,3-11H2,1-2H3,(H,15,17);2*1H.
What are the key properties of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride?
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride has a molecular weight of 330.30 g/mol, XLogP of 0.91, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-piperidin-4-ylacetamide;dihydrochloride is sourced from PubChem (CID 119871091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).