4-fluoro-2-propan-2-ylpiperidine;hydrochloride

C8H17ClFN — CID 115016067

IUPAC4-fluoro-2-propan-2-ylpiperidine;hydrochloride
SMILESCC(C)C1CC(F)CCN1.Cl
InChIInChI=1S/C8H16FN.ClH/c1-6(2)8-5-7(9)3-4-10-8;/h6-8,10H,3-5H2,1-2H3;1H
InChIKeySXANTSDHZXNSND-UHFFFAOYSA-N
MW181.68 g/mol
LogP2.15
Rot. Bonds1

About 4-fluoro-2-propan-2-ylpiperidine;hydrochloride

4-fluoro-2-propan-2-ylpiperidine;hydrochloride (PubChem CID 115016067) has the molecular formula C8H17ClFN and a molecular weight of 181.68 g/mol. Its IUPAC name is 4-fluoro-2-propan-2-ylpiperidine;hydrochloride.

Molecular Properties

Compound Name4-fluoro-2-propan-2-ylpiperidine;hydrochloride
PubChem CID115016067
Molecular FormulaC8H17ClFN
Molecular Weight181.68 g/mol
Exact Mass181.10
IUPAC Name4-fluoro-2-propan-2-ylpiperidine;hydrochloride
SMILESCC(C)C1CC(F)CCN1.Cl
InChIInChI=1S/C8H16FN.ClH/c1-6(2)8-5-7(9)3-4-10-8;/h6-8,10H,3-5H2,1-2H3;1H
InChIKeySXANTSDHZXNSND-UHFFFAOYSA-N
XLogP2.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.68
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-propan-2-ylpiperidine;hydrochloride?
The IUPAC name of 4-fluoro-2-propan-2-ylpiperidine;hydrochloride (CID 115016067) is 4-fluoro-2-propan-2-ylpiperidine;hydrochloride.
What is the SMILES notation for 4-fluoro-2-propan-2-ylpiperidine;hydrochloride?
The canonical SMILES for 4-fluoro-2-propan-2-ylpiperidine;hydrochloride is CC(C)C1CC(F)CCN1.Cl.
What is the InChIKey of 4-fluoro-2-propan-2-ylpiperidine;hydrochloride?
The InChIKey is SXANTSDHZXNSND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN.ClH/c1-6(2)8-5-7(9)3-4-10-8;/h6-8,10H,3-5H2,1-2H3;1H.
What are the key properties of 4-fluoro-2-propan-2-ylpiperidine;hydrochloride?
4-fluoro-2-propan-2-ylpiperidine;hydrochloride has a molecular weight of 181.68 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-propan-2-ylpiperidine;hydrochloride is sourced from PubChem (CID 115016067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).