2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine

C10H22N2O — CID 39237896

IUPAC2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine
SMILESCC1CCN(CCOCCN)CC1
InChIInChI=1S/C10H22N2O/c1-10-2-5-12(6-3-10)7-9-13-8-4-11/h10H,2-9,11H2,1H3
InChIKeyMVJWDJYMKFYPPR-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.69
Rot. Bonds5

About 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine

2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine (PubChem CID 39237896) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine
PubChem CID39237896
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine
SMILESCC1CCN(CCOCCN)CC1
InChIInChI=1S/C10H22N2O/c1-10-2-5-12(6-3-10)7-9-13-8-4-11/h10H,2-9,11H2,1H3
InChIKeyMVJWDJYMKFYPPR-UHFFFAOYSA-N
XLogP0.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.69
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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Related Compounds

1-[2-(2-aminoethoxy)ethyl]piperidin-4-amine;ethane
CID 156883236
1-[2-(2-aminoethoxy)ethyl]-N,N-dimethylpiperidin-4-amine
CID 79478502
2-[2-(4-ethoxypiperidin-1-yl)ethoxy]ethanamine
CID 79478299
ethane;2-(4-methylpiperidin-1-yl)ethanamine
CID 143291209
2-[2-(3,5-dimethylpiperidin-1-yl)ethoxy]ethanamine
CID 79478924
7-(4-methylpiperidin-1-yl)heptan-1-amine
CID 28596817
2-(4-methylpiperidin-1-yl)ethanamine;propane
CID 142306647
2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol
CID 166715109
2-(4-methylpiperidin-1-yl)ethoxymethanetriamine
CID 71080676
2-[2-[2-[2-[2-(2-but-3-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;1,4-dimethylpiperidine
CID 153358477
2-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine
CID 106453449
2-[2-(4,4-dimethylazepan-1-yl)ethoxy]ethanamine
CID 79478625

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine?
The IUPAC name of 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine (CID 39237896) is 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine is CC1CCN(CCOCCN)CC1.
What is the InChIKey of 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine?
The InChIKey is MVJWDJYMKFYPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10-2-5-12(6-3-10)7-9-13-8-4-11/h10H,2-9,11H2,1H3.
What are the key properties of 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine?
2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine has a molecular weight of 186.30 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine is sourced from PubChem (CID 39237896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).