4-ethoxy-1-propan-2-ylpiperidine

C10H21NO — CID 58110291

IUPAC4-ethoxy-1-propan-2-ylpiperidine
SMILESCCOC1CCN(C(C)C)CC1
InChIInChI=1S/C10H21NO/c1-4-12-10-5-7-11(8-6-10)9(2)3/h9-10H,4-8H2,1-3H3
InChIKeyQSQXCTKPDJKTSA-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.90
Rot. Bonds3

About 4-ethoxy-1-propan-2-ylpiperidine

4-ethoxy-1-propan-2-ylpiperidine (PubChem CID 58110291) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-ethoxy-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-ethoxy-1-propan-2-ylpiperidine
PubChem CID58110291
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-ethoxy-1-propan-2-ylpiperidine
SMILESCCOC1CCN(C(C)C)CC1
InChIInChI=1S/C10H21NO/c1-4-12-10-5-7-11(8-6-10)9(2)3/h9-10H,4-8H2,1-3H3
InChIKeyQSQXCTKPDJKTSA-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1-propan-2-ylpiperidine?
The IUPAC name of 4-ethoxy-1-propan-2-ylpiperidine (CID 58110291) is 4-ethoxy-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-ethoxy-1-propan-2-ylpiperidine?
The canonical SMILES for 4-ethoxy-1-propan-2-ylpiperidine is CCOC1CCN(C(C)C)CC1.
What is the InChIKey of 4-ethoxy-1-propan-2-ylpiperidine?
The InChIKey is QSQXCTKPDJKTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-12-10-5-7-11(8-6-10)9(2)3/h9-10H,4-8H2,1-3H3.
What are the key properties of 4-ethoxy-1-propan-2-ylpiperidine?
4-ethoxy-1-propan-2-ylpiperidine has a molecular weight of 171.28 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1-propan-2-ylpiperidine is sourced from PubChem (CID 58110291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).