N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride

C15H30ClN3O4 — CID 120623192

IUPACN-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
SMILESCOCCN(CC(=O)N(C)C)C(=O)C1(COC)CCNCC1.Cl
InChIInChI=1S/C15H29N3O4.ClH/c1-17(2)13(19)11-18(9-10-21-3)14(20)15(12-22-4)5-7-16-8-6-15;/h16H,5-12H2,1-4H3;1H
InChIKeyCGKOGEAJTBHVDB-UHFFFAOYSA-N
MW351.88 g/mol
LogP-0.01
Rot. Bonds8

About N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride

N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120623192) has the molecular formula C15H30ClN3O4 and a molecular weight of 351.88 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
PubChem CID120623192
Molecular FormulaC15H30ClN3O4
Molecular Weight351.88 g/mol
Exact Mass351.19
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
SMILESCOCCN(CC(=O)N(C)C)C(=O)C1(COC)CCNCC1.Cl
InChIInChI=1S/C15H29N3O4.ClH/c1-17(2)13(19)11-18(9-10-21-3)14(20)15(12-22-4)5-7-16-8-6-15;/h16H,5-12H2,1-4H3;1H
InChIKeyCGKOGEAJTBHVDB-UHFFFAOYSA-N
XLogP-0.01
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.88
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyethyl)-N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120626354
1-(aminomethyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119729842
N-ethyl-4-(methoxymethyl)-N-propylpiperidine-4-carboxamide;hydrochloride
CID 120620366
N-[2-(diethylamino)-2-oxoethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120617930
N-ethyl-N-(2-hydroxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042000
N-cyclopropyl-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120622234
N-(2,2-dimethylpropyl)-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120624655
N,N-bis(2-methoxyethyl)-4-methylpiperidine-4-carboxamide
CID 55179285
N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120637646
N,N-bis(2-ethoxyethyl)-4-ethylpiperidine-4-carboxamide
CID 82960199
4-(methoxymethyl)-N-methyl-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
CID 114042034
2-[[4-(methoxymethyl)piperidine-4-carbonyl]-methylamino]propanoic acid
CID 114042027

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride (CID 120623192) is N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride is COCCN(CC(=O)N(C)C)C(=O)C1(COC)CCNCC1.Cl.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is CGKOGEAJTBHVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O4.ClH/c1-17(2)13(19)11-18(9-10-21-3)14(20)15(12-22-4)5-7-16-8-6-15;/h16H,5-12H2,1-4H3;1H.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride?
N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 351.88 g/mol, XLogP of -0.01, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120623192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).