4-[ethoxy(difluoro)methyl]-1-ethylpiperidine

C10H19F2NO — CID 20723957

IUPAC4-[ethoxy(difluoro)methyl]-1-ethylpiperidine
SMILESCCOC(F)(F)C1CCN(CC)CC1
InChIInChI=1S/C10H19F2NO/c1-3-13-7-5-9(6-8-13)10(11,12)14-4-2/h9H,3-8H2,1-2H3
InChIKeyBYAPXJZHIWWCJQ-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.35
Rot. Bonds4

About 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine

4-[ethoxy(difluoro)methyl]-1-ethylpiperidine (PubChem CID 20723957) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine.

Molecular Properties

Compound Name4-[ethoxy(difluoro)methyl]-1-ethylpiperidine
PubChem CID20723957
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name4-[ethoxy(difluoro)methyl]-1-ethylpiperidine
SMILESCCOC(F)(F)C1CCN(CC)CC1
InChIInChI=1S/C10H19F2NO/c1-3-13-7-5-9(6-8-13)10(11,12)14-4-2/h9H,3-8H2,1-2H3
InChIKeyBYAPXJZHIWWCJQ-UHFFFAOYSA-N
XLogP2.35
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine?
The IUPAC name of 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine (CID 20723957) is 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine.
What is the SMILES notation for 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine?
The canonical SMILES for 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine is CCOC(F)(F)C1CCN(CC)CC1.
What is the InChIKey of 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine?
The InChIKey is BYAPXJZHIWWCJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-3-13-7-5-9(6-8-13)10(11,12)14-4-2/h9H,3-8H2,1-2H3.
What are the key properties of 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine?
4-[ethoxy(difluoro)methyl]-1-ethylpiperidine has a molecular weight of 207.26 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethoxy(difluoro)methyl]-1-ethylpiperidine is sourced from PubChem (CID 20723957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).