4-ethyl-3-fluoro-1-propan-2-ylpiperidine

C10H20FN — CID 89043570

IUPAC4-ethyl-3-fluoro-1-propan-2-ylpiperidine
SMILESCCC1CCN(C(C)C)CC1F
InChIInChI=1S/C10H20FN/c1-4-9-5-6-12(8(2)3)7-10(9)11/h8-10H,4-7H2,1-3H3
InChIKeyNXQJWZFRGHTINT-UHFFFAOYSA-N
MW173.28 g/mol
LogP2.46
Rot. Bonds2

About 4-ethyl-3-fluoro-1-propan-2-ylpiperidine

4-ethyl-3-fluoro-1-propan-2-ylpiperidine (PubChem CID 89043570) has the molecular formula C10H20FN and a molecular weight of 173.28 g/mol. Its IUPAC name is 4-ethyl-3-fluoro-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-ethyl-3-fluoro-1-propan-2-ylpiperidine
PubChem CID89043570
Molecular FormulaC10H20FN
Molecular Weight173.28 g/mol
Exact Mass173.16
IUPAC Name4-ethyl-3-fluoro-1-propan-2-ylpiperidine
SMILESCCC1CCN(C(C)C)CC1F
InChIInChI=1S/C10H20FN/c1-4-9-5-6-12(8(2)3)7-10(9)11/h8-10H,4-7H2,1-3H3
InChIKeyNXQJWZFRGHTINT-UHFFFAOYSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-fluoro-1-propan-2-ylpiperidine?
The IUPAC name of 4-ethyl-3-fluoro-1-propan-2-ylpiperidine (CID 89043570) is 4-ethyl-3-fluoro-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-ethyl-3-fluoro-1-propan-2-ylpiperidine?
The canonical SMILES for 4-ethyl-3-fluoro-1-propan-2-ylpiperidine is CCC1CCN(C(C)C)CC1F.
What is the InChIKey of 4-ethyl-3-fluoro-1-propan-2-ylpiperidine?
The InChIKey is NXQJWZFRGHTINT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-4-9-5-6-12(8(2)3)7-10(9)11/h8-10H,4-7H2,1-3H3.
What are the key properties of 4-ethyl-3-fluoro-1-propan-2-ylpiperidine?
4-ethyl-3-fluoro-1-propan-2-ylpiperidine has a molecular weight of 173.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-fluoro-1-propan-2-ylpiperidine is sourced from PubChem (CID 89043570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).