N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride

C15H29ClN2O3 — CID 120637646

IUPACN-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)N(C)CCOCC2CC2)CCNCC1.Cl
InChIInChI=1S/C15H28N2O3.ClH/c1-17(9-10-20-11-13-3-4-13)14(18)15(12-19-2)5-7-16-8-6-15;/h13,16H,3-12H2,1-2H3;1H
InChIKeyFJVGVGRJPJHBIP-UHFFFAOYSA-N
MW320.86 g/mol
LogP1.31
Rot. Bonds8

About N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride

N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride (PubChem CID 120637646) has the molecular formula C15H29ClN2O3 and a molecular weight of 320.86 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
PubChem CID120637646
Molecular FormulaC15H29ClN2O3
Molecular Weight320.86 g/mol
Exact Mass320.19
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)N(C)CCOCC2CC2)CCNCC1.Cl
InChIInChI=1S/C15H28N2O3.ClH/c1-17(9-10-20-11-13-3-4-13)14(18)15(12-19-2)5-7-16-8-6-15;/h13,16H,3-12H2,1-2H3;1H
InChIKeyFJVGVGRJPJHBIP-UHFFFAOYSA-N
XLogP1.31
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.86
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120622234
4-(methoxymethyl)-N-[2-(2-methoxyphenoxy)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120623439
N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119340564
N-(2,2-dimethylpropyl)-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120624655
N-(2-ethoxyethyl)-N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120626354
N-[2-(diethylamino)-2-oxoethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120617930
4-(methoxymethyl)-N-methyl-N-(oxan-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 120625217
N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623192
N-ethyl-4-(methoxymethyl)-N-propylpiperidine-4-carboxamide;hydrochloride
CID 120620366
2-[[4-(methoxymethyl)piperidine-4-carbonyl]-methylamino]propanoic acid
CID 114042027
N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119340577
N-[2-(cyclopropylmethoxy)ethyl]-1-(N'-hydroxycarbamimidoyl)-N-methylcyclopropane-1-carboxamide
CID 80594743

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride (CID 120637646) is N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride is COCC1(C(=O)N(C)CCOCC2CC2)CCNCC1.Cl.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride?
The InChIKey is FJVGVGRJPJHBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3.ClH/c1-17(9-10-20-11-13-3-4-13)14(18)15(12-19-2)5-7-16-8-6-15;/h13,16H,3-12H2,1-2H3;1H.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride?
N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride has a molecular weight of 320.86 g/mol, XLogP of 1.31, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120637646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).