1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine

C13H28N2O — CID 114942573

IUPAC1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine
SMILESCCOC(C)(C)CN1CCC(N)C(C)C1C
InChIInChI=1S/C13H28N2O/c1-6-16-13(4,5)9-15-8-7-12(14)10(2)11(15)3/h10-12H,6-9,14H2,1-5H3
InChIKeyFSXJBFNWUTYUDC-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.86
Rot. Bonds4

About 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine

1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine (PubChem CID 114942573) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine
PubChem CID114942573
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine
SMILESCCOC(C)(C)CN1CCC(N)C(C)C1C
InChIInChI=1S/C13H28N2O/c1-6-16-13(4,5)9-15-8-7-12(14)10(2)11(15)3/h10-12H,6-9,14H2,1-5H3
InChIKeyFSXJBFNWUTYUDC-UHFFFAOYSA-N
XLogP1.86
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine?
The IUPAC name of 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine (CID 114942573) is 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine is CCOC(C)(C)CN1CCC(N)C(C)C1C.
What is the InChIKey of 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine?
The InChIKey is FSXJBFNWUTYUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-6-16-13(4,5)9-15-8-7-12(14)10(2)11(15)3/h10-12H,6-9,14H2,1-5H3.
What are the key properties of 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine?
1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-2-methylpropyl)-2,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 114942573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).