1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide

C13H26N2O3 — CID 75424732

IUPAC1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
SMILESCOCCOCCN1CCCC(C(=O)N(C)C)C1
InChIInChI=1S/C13H26N2O3/c1-14(2)13(16)12-5-4-6-15(11-12)7-8-18-10-9-17-3/h12H,4-11H2,1-3H3
InChIKeyCMFDIWPXOPQDMZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.45
Rot. Bonds7

About 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide

1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide (PubChem CID 75424732) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
PubChem CID75424732
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
SMILESCOCCOCCN1CCCC(C(=O)N(C)C)C1
InChIInChI=1S/C13H26N2O3/c1-14(2)13(16)12-5-4-6-15(11-12)7-8-18-10-9-17-3/h12H,4-11H2,1-3H3
InChIKeyCMFDIWPXOPQDMZ-UHFFFAOYSA-N
XLogP0.45
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 1-[2-(2-methoxyethoxy)ethyl]piperidine-3-carboxylate
CID 79884507
1-(4-hydroxybutyl)-N,N-dimethylpiperidine-3-carboxamide
CID 110931950
1-[1-(2-methoxyethyl)piperidin-3-yl]ethanone
CID 63845115
(3S)-1-(2-methoxyethyl)piperidine-3-carboxylic acid
CID 27440266
N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide
CID 59535798
1-[2-[2-[3-(dimethylcarbamoyl)piperidin-1-yl]ethylsulfonyl]ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 56526123
methyl 1-(2-methoxyethyl)piperidine-3-carboxylate
CID 78920456
3-chloro-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidine
CID 104567095
1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine
CID 77147850
1-[2-(2-chlorophenoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 86869685
1-(2-propoxyethyl)piperidine-3-carboxylic acid
CID 106454575
1-(2-methoxyethyl)-N-methylpiperidine-3-carboxamide
CID 143767660

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide (CID 75424732) is 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide is COCCOCCN1CCCC(C(=O)N(C)C)C1.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide?
The InChIKey is CMFDIWPXOPQDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-14(2)13(16)12-5-4-6-15(11-12)7-8-18-10-9-17-3/h12H,4-11H2,1-3H3.
What are the key properties of 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide?
1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 0.45, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 75424732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).