4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine

C11H16FNO — CID 123305771

IUPAC4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine
SMILESCC1(F)CCN(Cc2ccoc2)CC1
InChIInChI=1S/C11H16FNO/c1-11(12)3-5-13(6-4-11)8-10-2-7-14-9-10/h2,7,9H,3-6,8H2,1H3
InChIKeyFLHYJKRLDHRVRD-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.60
Rot. Bonds2

About 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine

4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine (PubChem CID 123305771) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine.

Molecular Properties

Compound Name4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine
PubChem CID123305771
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine
SMILESCC1(F)CCN(Cc2ccoc2)CC1
InChIInChI=1S/C11H16FNO/c1-11(12)3-5-13(6-4-11)8-10-2-7-14-9-10/h2,7,9H,3-6,8H2,1H3
InChIKeyFLHYJKRLDHRVRD-UHFFFAOYSA-N
XLogP2.60
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine?
The IUPAC name of 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine (CID 123305771) is 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine.
What is the SMILES notation for 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine?
The canonical SMILES for 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine is CC1(F)CCN(Cc2ccoc2)CC1.
What is the InChIKey of 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine?
The InChIKey is FLHYJKRLDHRVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-11(12)3-5-13(6-4-11)8-10-2-7-14-9-10/h2,7,9H,3-6,8H2,1H3.
What are the key properties of 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine?
4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine has a molecular weight of 197.25 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(furan-3-ylmethyl)-4-methylpiperidine is sourced from PubChem (CID 123305771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).