N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide

C11H20N2O2 — CID 102548593

IUPACN,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide
SMILESCN(C)C(=O)C1CCCN(CC2CO2)C1
InChIInChI=1S/C11H20N2O2/c1-12(2)11(14)9-4-3-5-13(6-9)7-10-8-15-10/h9-10H,3-8H2,1-2H3
InChIKeyLTOJWAYLLJYTGZ-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.19
Rot. Bonds3

About N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide

N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 102548593) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide
PubChem CID102548593
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide
SMILESCN(C)C(=O)C1CCCN(CC2CO2)C1
InChIInChI=1S/C11H20N2O2/c1-12(2)11(14)9-4-3-5-13(6-9)7-10-8-15-10/h9-10H,3-8H2,1-2H3
InChIKeyLTOJWAYLLJYTGZ-UHFFFAOYSA-N
XLogP0.19
TPSA36.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

1-[2-[2-[3-(dimethylcarbamoyl)piperidin-1-yl]ethylsulfonyl]ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 56526123
1-(4-hydroxybutyl)-N,N-dimethylpiperidine-3-carboxamide
CID 110931950
1-[(2R)-2-hydroxybutyl]-N,N-dimethylpiperidine-3-carboxamide
CID 111487608
1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 75424732
1-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanone
CID 64532918
1-(1,4-dioxan-2-ylmethyl)-N-pentan-2-ylpiperidine-3-carboxamide
CID 126816532
1-(oxiran-2-ylmethyl)pyrrolidine
CID 13313617
1-[[(2R)-oxiran-2-yl]methyl]pyrrolidine
CID 40505235
1-heptan-4-yl-N,N-dimethylpiperidine-3-carboxamide
CID 174980443
3-methyl-1-(oxiran-2-ylmethyl)-azacyclopentadecane
CID 146534303
1-tert-butyl-N,N-dimethylpiperidine-3-carboxamide
CID 58877729
tert-butyl 1-(oxiran-2-ylmethyl)pyrrolidine-3-carboxylate
CID 71628648

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide (CID 102548593) is N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide is CN(C)C(=O)C1CCCN(CC2CO2)C1.
What is the InChIKey of N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is LTOJWAYLLJYTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-12(2)11(14)9-4-3-5-13(6-9)7-10-8-15-10/h9-10H,3-8H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide?
N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 102548593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).