8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride

C15H19ClFN3 — CID 129251175

IUPAC8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride
SMILESCC1CNCC(Nc2ccc(F)c3ncccc23)C1.Cl
InChIInChI=1S/C15H18FN3.ClH/c1-10-7-11(9-17-8-10)19-14-5-4-13(16)15-12(14)3-2-6-18-15;/h2-6,10-11,17,19H,7-9H2,1H3;1H
InChIKeyISJWRHXXOPXGFY-UHFFFAOYSA-N
MW295.79 g/mol
LogP3.21
Rot. Bonds2

About 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride

8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride (PubChem CID 129251175) has the molecular formula C15H19ClFN3 and a molecular weight of 295.79 g/mol. Its IUPAC name is 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride.

Molecular Properties

Compound Name8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride
PubChem CID129251175
Molecular FormulaC15H19ClFN3
Molecular Weight295.79 g/mol
Exact Mass295.13
IUPAC Name8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride
SMILESCC1CNCC(Nc2ccc(F)c3ncccc23)C1.Cl
InChIInChI=1S/C15H18FN3.ClH/c1-10-7-11(9-17-8-10)19-14-5-4-13(16)15-12(14)3-2-6-18-15;/h2-6,10-11,17,19H,7-9H2,1H3;1H
InChIKeyISJWRHXXOPXGFY-UHFFFAOYSA-N
XLogP3.21
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.79
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride?
The IUPAC name of 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride (CID 129251175) is 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride.
What is the SMILES notation for 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride?
The canonical SMILES for 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride is CC1CNCC(Nc2ccc(F)c3ncccc23)C1.Cl.
What is the InChIKey of 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride?
The InChIKey is ISJWRHXXOPXGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3.ClH/c1-10-7-11(9-17-8-10)19-14-5-4-13(16)15-12(14)3-2-6-18-15;/h2-6,10-11,17,19H,7-9H2,1H3;1H.
What are the key properties of 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride?
8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride has a molecular weight of 295.79 g/mol, XLogP of 3.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N-(5-methylpiperidin-3-yl)quinolin-5-amine;hydrochloride is sourced from PubChem (CID 129251175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).