3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine

C13H28N2O — CID 114507946

IUPAC3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine
SMILESCCC1CN(CCOC(C)C)CCC1NC
InChIInChI=1S/C13H28N2O/c1-5-12-10-15(7-6-13(12)14-4)8-9-16-11(2)3/h11-14H,5-10H2,1-4H3
InChIKeyOWLLBICUPQGSTQ-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds6

About 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine

3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine (PubChem CID 114507946) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine.

Molecular Properties

Compound Name3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine
PubChem CID114507946
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine
SMILESCCC1CN(CCOC(C)C)CCC1NC
InChIInChI=1S/C13H28N2O/c1-5-12-10-15(7-6-13(12)14-4)8-9-16-11(2)3/h11-14H,5-10H2,1-4H3
InChIKeyOWLLBICUPQGSTQ-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

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Related Compounds

3-[3-ethyl-4-(methylamino)piperidin-1-yl]propan-1-ol
CID 114507793
1-[2-(dimethylamino)ethyl]-3-ethyl-N-methylpiperidin-4-amine
CID 114507992
N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
CID 119923511
1-(2-propan-2-yloxyethyl)-N-propylpyrrolidin-3-amine
CID 104761908
3-ethyl-1-(3-ethylsulfonylpropyl)-N-methylpiperidin-4-amine
CID 114507903
3-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
CID 114507781
3-ethyl-N,1-dimethylpiperidin-4-amine
CID 114507994
N-methyl-1-[1-(2-propan-2-yloxyethyl)pyrrolidin-3-yl]methanamine;hydrochloride
CID 119922056
3-bromo-1-(2-propan-2-yloxyethyl)pyrrolidine
CID 80676052
3-ethyl-N-methyl-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 114507762
3-[3-ethyl-4-(methylamino)piperidin-1-yl]-1,1,1-trifluoropropan-2-ol
CID 114507900
3-ethyl-N-methyl-1-[(1-methyltriazol-4-yl)methyl]piperidin-4-amine
CID 107040761

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine?
The IUPAC name of 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine (CID 114507946) is 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine.
What is the SMILES notation for 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine?
The canonical SMILES for 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine is CCC1CN(CCOC(C)C)CCC1NC.
What is the InChIKey of 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine?
The InChIKey is OWLLBICUPQGSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-5-12-10-15(7-6-13(12)14-4)8-9-16-11(2)3/h11-14H,5-10H2,1-4H3.
What are the key properties of 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine?
3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)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 3-ethyl-N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine is sourced from PubChem (CID 114507946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).