N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine

C13H28N2O — CID 106455102

IUPACN,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine
SMILESCNC1(C)CCN(CCOCC(C)C)CC1
InChIInChI=1S/C13H28N2O/c1-12(2)11-16-10-9-15-7-5-13(3,14-4)6-8-15/h12,14H,5-11H2,1-4H3
InChIKeyVACGVRXZTDTDKK-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds6

About N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine

N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine (PubChem CID 106455102) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine
PubChem CID106455102
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine
SMILESCNC1(C)CCN(CCOCC(C)C)CC1
InChIInChI=1S/C13H28N2O/c1-12(2)11-16-10-9-15-7-5-13(3,14-4)6-8-15/h12,14H,5-11H2,1-4H3
InChIKeyVACGVRXZTDTDKK-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.73
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

4-(fluoromethyl)-4-methyl-1-[2-(2-methylpropoxy)ethyl]piperidine
CID 177032197
2-[4-[2-(2-methylpropoxy)ethyl]piperazin-1-yl]ethanamine
CID 106450826
1-(2-bromoethyl)-4-[2-(2-methylpropoxy)ethyl]piperazine
CID 106457754
1-[2-(2-ethoxyphenoxy)ethyl]-N,4-dimethylpiperidin-4-amine
CID 115305364
4-bromo-1-[2-(2-methylpropoxy)ethyl]piperidine
CID 106457766
1-(2-cyclopropylethyl)-N,4-dimethylpiperidin-4-amine
CID 115305380
2-[4-methyl-4-(methylamino)piperidin-1-yl]ethanesulfonamide
CID 114385516
1-but-3-ynyl-N,4-dimethylpiperidin-4-amine
CID 115305025
N-[[1-[2-(2-methylpropoxy)ethyl]piperidin-4-yl]methyl]cyclopropanamine
CID 106453510
1-(1-methoxy-3-methylbutan-2-yl)-N,4-dimethylpiperidin-4-amine
CID 115304094
4-(1-bromoethyl)-1-[2-(2-methylpropoxy)ethyl]piperidine
CID 106838360
4-(2-bromoethoxy)-1-[2-(2-methylpropoxy)ethyl]piperidine
CID 106457800

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine?
The IUPAC name of N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine (CID 106455102) is N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine.
What is the SMILES notation for N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine?
The canonical SMILES for N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine is CNC1(C)CCN(CCOCC(C)C)CC1.
What is the InChIKey of N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine?
The InChIKey is VACGVRXZTDTDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12(2)11-16-10-9-15-7-5-13(3,14-4)6-8-15/h12,14H,5-11H2,1-4H3.
What are the key properties of N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine?
N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-[2-(2-methylpropoxy)ethyl]piperidin-4-amine is sourced from PubChem (CID 106455102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).