4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine

C14H26FN — CID 165137260

IUPAC4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine
SMILESC=C(C(CC)CC)N1CCC(F)(CC)CC1
InChIInChI=1S/C14H26FN/c1-5-13(6-2)12(4)16-10-8-14(15,7-3)9-11-16/h13H,4-11H2,1-3H3
InChIKeyYUEYJNRIMMNMQV-UHFFFAOYSA-N
MW227.37 g/mol
LogP4.15
Rot. Bonds5

About 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine

4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine (PubChem CID 165137260) has the molecular formula C14H26FN and a molecular weight of 227.37 g/mol. Its IUPAC name is 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine.

Molecular Properties

Compound Name4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine
PubChem CID165137260
Molecular FormulaC14H26FN
Molecular Weight227.37 g/mol
Exact Mass227.20
IUPAC Name4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine
SMILESC=C(C(CC)CC)N1CCC(F)(CC)CC1
InChIInChI=1S/C14H26FN/c1-5-13(6-2)12(4)16-10-8-14(15,7-3)9-11-16/h13H,4-11H2,1-3H3
InChIKeyYUEYJNRIMMNMQV-UHFFFAOYSA-N
XLogP4.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.37
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine?
The IUPAC name of 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine (CID 165137260) is 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine.
What is the SMILES notation for 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine?
The canonical SMILES for 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine is C=C(C(CC)CC)N1CCC(F)(CC)CC1.
What is the InChIKey of 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine?
The InChIKey is YUEYJNRIMMNMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26FN/c1-5-13(6-2)12(4)16-10-8-14(15,7-3)9-11-16/h13H,4-11H2,1-3H3.
What are the key properties of 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine?
4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine has a molecular weight of 227.37 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine is sourced from PubChem (CID 165137260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).