3-(4,4-difluoropiperidin-1-yl)quinoline

C14H14F2N2 — CID 144553377

IUPAC3-(4,4-difluoropiperidin-1-yl)quinoline
SMILESFC1(F)CCN(c2cnc3ccccc3c2)CC1
InChIInChI=1S/C14H14F2N2/c15-14(16)5-7-18(8-6-14)12-9-11-3-1-2-4-13(11)17-10-12/h1-4,9-10H,5-8H2
InChIKeyFNQUYUQQBSVWST-UHFFFAOYSA-N
MW248.28 g/mol
LogP3.47
Rot. Bonds1

About 3-(4,4-difluoropiperidin-1-yl)quinoline

3-(4,4-difluoropiperidin-1-yl)quinoline (PubChem CID 144553377) has the molecular formula C14H14F2N2 and a molecular weight of 248.28 g/mol. Its IUPAC name is 3-(4,4-difluoropiperidin-1-yl)quinoline.

Molecular Properties

Compound Name3-(4,4-difluoropiperidin-1-yl)quinoline
PubChem CID144553377
Molecular FormulaC14H14F2N2
Molecular Weight248.28 g/mol
Exact Mass248.11
IUPAC Name3-(4,4-difluoropiperidin-1-yl)quinoline
SMILESFC1(F)CCN(c2cnc3ccccc3c2)CC1
InChIInChI=1S/C14H14F2N2/c15-14(16)5-7-18(8-6-14)12-9-11-3-1-2-4-13(11)17-10-12/h1-4,9-10H,5-8H2
InChIKeyFNQUYUQQBSVWST-UHFFFAOYSA-N
XLogP3.47
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4,4-difluoropiperidin-1-yl)quinoline?
The IUPAC name of 3-(4,4-difluoropiperidin-1-yl)quinoline (CID 144553377) is 3-(4,4-difluoropiperidin-1-yl)quinoline.
What is the SMILES notation for 3-(4,4-difluoropiperidin-1-yl)quinoline?
The canonical SMILES for 3-(4,4-difluoropiperidin-1-yl)quinoline is FC1(F)CCN(c2cnc3ccccc3c2)CC1.
What is the InChIKey of 3-(4,4-difluoropiperidin-1-yl)quinoline?
The InChIKey is FNQUYUQQBSVWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2/c15-14(16)5-7-18(8-6-14)12-9-11-3-1-2-4-13(11)17-10-12/h1-4,9-10H,5-8H2.
What are the key properties of 3-(4,4-difluoropiperidin-1-yl)quinoline?
3-(4,4-difluoropiperidin-1-yl)quinoline has a molecular weight of 248.28 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-difluoropiperidin-1-yl)quinoline is sourced from PubChem (CID 144553377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).