N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide

C11H22N2O3 — CID 56764447

IUPACN-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide
SMILESCOCCNC(=O)N1CCCC(COC)C1
InChIInChI=1S/C11H22N2O3/c1-15-7-5-12-11(14)13-6-3-4-10(8-13)9-16-2/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyGUPLQDXBSCTVLK-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.70
Rot. Bonds5

About N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide

N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide (PubChem CID 56764447) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide
PubChem CID56764447
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide
SMILESCOCCNC(=O)N1CCCC(COC)C1
InChIInChI=1S/C11H22N2O3/c1-15-7-5-12-11(14)13-6-3-4-10(8-13)9-16-2/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyGUPLQDXBSCTVLK-UHFFFAOYSA-N
XLogP0.70
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide (CID 56764447) is N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide is COCCNC(=O)N1CCCC(COC)C1.
What is the InChIKey of N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide?
The InChIKey is GUPLQDXBSCTVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-15-7-5-12-11(14)13-6-3-4-10(8-13)9-16-2/h10H,3-9H2,1-2H3,(H,12,14).
What are the key properties of N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide?
N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide has a molecular weight of 230.31 g/mol, XLogP of 0.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-(methoxymethyl)piperidine-1-carboxamide is sourced from PubChem (CID 56764447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).