2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine

C14H28N2O — CID 63741474

IUPAC2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine
SMILESCC1CCN(C(CN)C2CCCOC2)C(C)C1
InChIInChI=1S/C14H28N2O/c1-11-5-6-16(12(2)8-11)14(9-15)13-4-3-7-17-10-13/h11-14H,3-10,15H2,1-2H3
InChIKeySOEXFBNKOYRDJR-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.86
Rot. Bonds3

About 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine

2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine (PubChem CID 63741474) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine
PubChem CID63741474
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine
SMILESCC1CCN(C(CN)C2CCCOC2)C(C)C1
InChIInChI=1S/C14H28N2O/c1-11-5-6-16(12(2)8-11)14(9-15)13-4-3-7-17-10-13/h11-14H,3-10,15H2,1-2H3
InChIKeySOEXFBNKOYRDJR-UHFFFAOYSA-N
XLogP1.86
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-4-yl)ethanamine
CID 62386327
1-[2-amino-1-(oxan-3-yl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 55242614
2-(3-methylpyrrolidin-1-yl)-2-(oxolan-3-yl)ethanamine
CID 61222169
2-(1,3-dihydroisoindol-2-yl)-2-(oxan-3-yl)ethanamine
CID 63741473
2-(4,4-dimethylazepan-1-yl)-2-(oxolan-3-yl)ethanamine
CID 65283837
2-(2,4-dimethylpiperidin-1-yl)-3,3,3-trifluoropropan-1-amine
CID 62332099
1-[2-amino-1-(oxolan-3-yl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166511
(1S)-1-[(3R)-oxan-3-yl]ethanamine
CID 96637700
(2R,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 176766721
(2S,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 177325259
4-(2,4-dimethylpiperidin-1-yl)pentan-2-amine
CID 64708883
2-(2,4-dimethylpiperidin-1-yl)-3-methylhexan-1-amine
CID 62331005

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine (CID 63741474) is 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine is CC1CCN(C(CN)C2CCCOC2)C(C)C1.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine?
The InChIKey is SOEXFBNKOYRDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11-5-6-16(12(2)8-11)14(9-15)13-4-3-7-17-10-13/h11-14H,3-10,15H2,1-2H3.
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine?
2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine has a molecular weight of 240.39 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-3-yl)ethanamine is sourced from PubChem (CID 63741474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).