3-ethoxy-3-piperidin-3-ylpropan-1-amine

C10H22N2O — CID 105442327

IUPAC3-ethoxy-3-piperidin-3-ylpropan-1-amine
SMILESCCOC(CCN)C1CCCNC1
InChIInChI=1S/C10H22N2O/c1-2-13-10(5-6-11)9-4-3-7-12-8-9/h9-10,12H,2-8,11H2,1H3
InChIKeyMAMZKASUGQCFRS-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.74
Rot. Bonds5

About 3-ethoxy-3-piperidin-3-ylpropan-1-amine

3-ethoxy-3-piperidin-3-ylpropan-1-amine (PubChem CID 105442327) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-ethoxy-3-piperidin-3-ylpropan-1-amine.

Molecular Properties

Compound Name3-ethoxy-3-piperidin-3-ylpropan-1-amine
PubChem CID105442327
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-ethoxy-3-piperidin-3-ylpropan-1-amine
SMILESCCOC(CCN)C1CCCNC1
InChIInChI=1S/C10H22N2O/c1-2-13-10(5-6-11)9-4-3-7-12-8-9/h9-10,12H,2-8,11H2,1H3
InChIKeyMAMZKASUGQCFRS-UHFFFAOYSA-N
XLogP0.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-3-piperidin-3-ylpropan-1-amine?
The IUPAC name of 3-ethoxy-3-piperidin-3-ylpropan-1-amine (CID 105442327) is 3-ethoxy-3-piperidin-3-ylpropan-1-amine.
What is the SMILES notation for 3-ethoxy-3-piperidin-3-ylpropan-1-amine?
The canonical SMILES for 3-ethoxy-3-piperidin-3-ylpropan-1-amine is CCOC(CCN)C1CCCNC1.
What is the InChIKey of 3-ethoxy-3-piperidin-3-ylpropan-1-amine?
The InChIKey is MAMZKASUGQCFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-13-10(5-6-11)9-4-3-7-12-8-9/h9-10,12H,2-8,11H2,1H3.
What are the key properties of 3-ethoxy-3-piperidin-3-ylpropan-1-amine?
3-ethoxy-3-piperidin-3-ylpropan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-3-piperidin-3-ylpropan-1-amine is sourced from PubChem (CID 105442327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).