2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine

C14H28FNO — CID 175612377

IUPAC2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine
SMILESCC(F)OCC1CCCC(C(C)C)N1C(C)C
InChIInChI=1S/C14H28FNO/c1-10(2)14-8-6-7-13(9-17-12(5)15)16(14)11(3)4/h10-14H,6-9H2,1-5H3
InChIKeyURWCXTWMFDYNMO-UHFFFAOYSA-N
MW245.38 g/mol
LogP3.61
Rot. Bonds5

About 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine

2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine (PubChem CID 175612377) has the molecular formula C14H28FNO and a molecular weight of 245.38 g/mol. Its IUPAC name is 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine.

Molecular Properties

Compound Name2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine
PubChem CID175612377
Molecular FormulaC14H28FNO
Molecular Weight245.38 g/mol
Exact Mass245.22
IUPAC Name2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine
SMILESCC(F)OCC1CCCC(C(C)C)N1C(C)C
InChIInChI=1S/C14H28FNO/c1-10(2)14-8-6-7-13(9-17-12(5)15)16(14)11(3)4/h10-14H,6-9H2,1-5H3
InChIKeyURWCXTWMFDYNMO-UHFFFAOYSA-N
XLogP3.61
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.38
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine?
The IUPAC name of 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine (CID 175612377) is 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine.
What is the SMILES notation for 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine?
The canonical SMILES for 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine is CC(F)OCC1CCCC(C(C)C)N1C(C)C.
What is the InChIKey of 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine?
The InChIKey is URWCXTWMFDYNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28FNO/c1-10(2)14-8-6-7-13(9-17-12(5)15)16(14)11(3)4/h10-14H,6-9H2,1-5H3.
What are the key properties of 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine?
2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine has a molecular weight of 245.38 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoroethoxymethyl)-1,6-di(propan-2-yl)piperidine is sourced from PubChem (CID 175612377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).