3-ethyl-5-(fluoromethyl)piperidine

C8H16FN — CID 154686945

IUPAC3-ethyl-5-(fluoromethyl)piperidine
SMILESCCC1CNCC(CF)C1
InChIInChI=1S/C8H16FN/c1-2-7-3-8(4-9)6-10-5-7/h7-8,10H,2-6H2,1H3
InChIKeyVVEVXWGWBWRFQJ-UHFFFAOYSA-N
MW145.22 g/mol
LogP1.59
Rot. Bonds2

About 3-ethyl-5-(fluoromethyl)piperidine

3-ethyl-5-(fluoromethyl)piperidine (PubChem CID 154686945) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 3-ethyl-5-(fluoromethyl)piperidine.

Molecular Properties

Compound Name3-ethyl-5-(fluoromethyl)piperidine
PubChem CID154686945
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name3-ethyl-5-(fluoromethyl)piperidine
SMILESCCC1CNCC(CF)C1
InChIInChI=1S/C8H16FN/c1-2-7-3-8(4-9)6-10-5-7/h7-8,10H,2-6H2,1H3
InChIKeyVVEVXWGWBWRFQJ-UHFFFAOYSA-N
XLogP1.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-Ethyl-2-methylpiperidine
CID 7727
4-Propylpiperidine
CID 31169
3-Ethylpiperidine
CID 202966
2,3-Dimethylpiperidine
CID 95359
Piperidine, 4-(1,1-dimethylethyl)-
CID 74661
Piperidine, 4-(1-methylethyl)-
CID 140569
3-(Propan-2-yl)piperidine
CID 541786
2,4,6-Trimethylpiperidine
CID 89562
2,4-Dimethylpiperidine
CID 95423
3-Propylpiperidine
CID 114550
Dimethyl(2-(piperidin-4-yl)ethyl)amine
CID 1415681
4-Octylpiperidine hydrochloride
CID 24181035

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(fluoromethyl)piperidine?
The IUPAC name of 3-ethyl-5-(fluoromethyl)piperidine (CID 154686945) is 3-ethyl-5-(fluoromethyl)piperidine.
What is the SMILES notation for 3-ethyl-5-(fluoromethyl)piperidine?
The canonical SMILES for 3-ethyl-5-(fluoromethyl)piperidine is CCC1CNCC(CF)C1.
What is the InChIKey of 3-ethyl-5-(fluoromethyl)piperidine?
The InChIKey is VVEVXWGWBWRFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-2-7-3-8(4-9)6-10-5-7/h7-8,10H,2-6H2,1H3.
What are the key properties of 3-ethyl-5-(fluoromethyl)piperidine?
3-ethyl-5-(fluoromethyl)piperidine has a molecular weight of 145.22 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(fluoromethyl)piperidine is sourced from PubChem (CID 154686945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).