1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine

C19H21F2NO — CID 71259897

IUPAC1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine
SMILESCOC1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1
InChIInChI=1S/C19H21F2NO/c1-23-18-10-12-22(13-11-18)19(14-2-6-16(20)7-3-14)15-4-8-17(21)9-5-15/h2-9,18-19H,10-13H2,1H3
InChIKeyGJWIWSXTSFGNAE-UHFFFAOYSA-N
MW317.38 g/mol
LogP4.16
Rot. Bonds4

About 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine

1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine (PubChem CID 71259897) has the molecular formula C19H21F2NO and a molecular weight of 317.38 g/mol. Its IUPAC name is 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine.

Molecular Properties

Compound Name1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine
PubChem CID71259897
Molecular FormulaC19H21F2NO
Molecular Weight317.38 g/mol
Exact Mass317.16
IUPAC Name1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine
SMILESCOC1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1
InChIInChI=1S/C19H21F2NO/c1-23-18-10-12-22(13-11-18)19(14-2-6-16(20)7-3-14)15-4-8-17(21)9-5-15/h2-9,18-19H,10-13H2,1H3
InChIKeyGJWIWSXTSFGNAE-UHFFFAOYSA-N
XLogP4.16
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.38
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine?
The IUPAC name of 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine (CID 71259897) is 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine.
What is the SMILES notation for 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine?
The canonical SMILES for 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine is COC1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1.
What is the InChIKey of 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine?
The InChIKey is GJWIWSXTSFGNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2NO/c1-23-18-10-12-22(13-11-18)19(14-2-6-16(20)7-3-14)15-4-8-17(21)9-5-15/h2-9,18-19H,10-13H2,1H3.
What are the key properties of 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine?
1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine has a molecular weight of 317.38 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(4-fluorophenyl)methyl]-4-methoxypiperidine is sourced from PubChem (CID 71259897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).