3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine

C10H20FN — CID 156794238

IUPAC3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine
SMILESCC(C)C1C(C)CN(C)CC1F
InChIInChI=1S/C10H20FN/c1-7(2)10-8(3)5-12(4)6-9(10)11/h7-10H,5-6H2,1-4H3
InChIKeyOEPUJQPLRVFBLW-UHFFFAOYSA-N
MW173.27 g/mol
LogP2.18
Rot. Bonds1

About 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine

3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine (PubChem CID 156794238) has the molecular formula C10H20FN and a molecular weight of 173.27 g/mol. Its IUPAC name is 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine
PubChem CID156794238
Molecular FormulaC10H20FN
Molecular Weight173.27 g/mol
Exact Mass173.16
IUPAC Name3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine
SMILESCC(C)C1C(C)CN(C)CC1F
InChIInChI=1S/C10H20FN/c1-7(2)10-8(3)5-12(4)6-9(10)11/h7-10H,5-6H2,1-4H3
InChIKeyOEPUJQPLRVFBLW-UHFFFAOYSA-N
XLogP2.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.27
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine?
The IUPAC name of 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine (CID 156794238) is 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine.
What is the SMILES notation for 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine?
The canonical SMILES for 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine is CC(C)C1C(C)CN(C)CC1F.
What is the InChIKey of 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine?
The InChIKey is OEPUJQPLRVFBLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-7(2)10-8(3)5-12(4)6-9(10)11/h7-10H,5-6H2,1-4H3.
What are the key properties of 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine?
3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine has a molecular weight of 173.27 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1,5-dimethyl-4-propan-2-ylpiperidine is sourced from PubChem (CID 156794238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).