N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride

C12H25ClN2O3 — CID 120620372

IUPACN-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
SMILESCCOCCNC(=O)C1(COC)CCNCC1.Cl
InChIInChI=1S/C12H24N2O3.ClH/c1-3-17-9-8-14-11(15)12(10-16-2)4-6-13-7-5-12;/h13H,3-10H2,1-2H3,(H,14,15);1H
InChIKeyAUNHOZZUAJHWOH-UHFFFAOYSA-N
MW280.80 g/mol
LogP0.58
Rot. Bonds7

About N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride

N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120620372) has the molecular formula C12H25ClN2O3 and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
PubChem CID120620372
Molecular FormulaC12H25ClN2O3
Molecular Weight280.80 g/mol
Exact Mass280.16
IUPAC NameN-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
SMILESCCOCCNC(=O)C1(COC)CCNCC1.Cl
InChIInChI=1S/C12H24N2O3.ClH/c1-3-17-9-8-14-11(15)12(10-16-2)4-6-13-7-5-12;/h13H,3-10H2,1-2H3,(H,14,15);1H
InChIKeyAUNHOZZUAJHWOH-UHFFFAOYSA-N
XLogP0.58
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120638803
4-(methoxymethyl)-N-(2-phenoxyethyl)piperidine-4-carboxamide;hydrochloride
CID 120617692
4-(methoxymethyl)-N-(4,4,4-trifluorobutyl)piperidine-4-carboxamide;hydrochloride
CID 120632253
4-(methoxymethyl)-N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 120633664
N-[2-(2,6-dimethylphenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120623806
N-[2-(1-adamantyl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120617106
N-[2-(3-chlorophenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623811
N-(2-ethoxyethyl)-N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120626354
4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide
CID 106391030
methyl 2-[2-[[4-(methoxymethyl)piperidine-4-carbonyl]amino]ethylsulfanyl]acetate
CID 120631431
N-[3-(azepan-1-yl)-3-oxopropyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120629091

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride (CID 120620372) is N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride is CCOCCNC(=O)C1(COC)CCNCC1.Cl.
What is the InChIKey of N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is AUNHOZZUAJHWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3.ClH/c1-3-17-9-8-14-11(15)12(10-16-2)4-6-13-7-5-12;/h13H,3-10H2,1-2H3,(H,14,15);1H.
What are the key properties of N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 280.80 g/mol, XLogP of 0.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120620372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).