4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine

C17H24F2N2 — CID 120851603

IUPAC4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine
SMILESFc1cccc(F)c1C1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C17H24F2N2/c18-15-2-1-3-16(19)17(15)14-6-10-21(11-7-14)12-13-4-8-20-9-5-13/h1-3,13-14,20H,4-12H2
InChIKeyUSDQXRNIQACZRT-UHFFFAOYSA-N
MW294.39 g/mol
LogP3.14
Rot. Bonds3

About 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine

4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine (PubChem CID 120851603) has the molecular formula C17H24F2N2 and a molecular weight of 294.39 g/mol. Its IUPAC name is 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine.

Molecular Properties

Compound Name4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine
PubChem CID120851603
Molecular FormulaC17H24F2N2
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine
SMILESFc1cccc(F)c1C1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C17H24F2N2/c18-15-2-1-3-16(19)17(15)14-6-10-21(11-7-14)12-13-4-8-20-9-5-13/h1-3,13-14,20H,4-12H2
InChIKeyUSDQXRNIQACZRT-UHFFFAOYSA-N
XLogP3.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine with MolForge

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

Launch Full Analysis

Related Compounds

3-[[3-(2,6-difluorophenyl)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 120849667
4-[[3-(3-fluorophenyl)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 119931475
(2,6-difluorophenyl)-[4-(piperidin-4-ylmethyl)piperazin-1-yl]methanone;hydrochloride
CID 119931000
4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine
CID 18328928
4-phenyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119931344
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
4-[(4-fluorophenyl)methyl]-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119931258
(2-chloro-6-fluorophenyl)-[4-(piperidin-4-ylmethyl)piperazin-1-yl]methanone;hydrochloride
CID 119930996
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
4-fluoro-2-(piperidin-4-ylmethyl)isoindole-1,3-dione
CID 22247872
1-[(4-fluoro-2,3-dihydro-1-benzofuran-3-yl)methyl]piperazine
CID 117199662
1-[4-(2,6-difluorophenyl)piperidin-1-yl]-2-methylpropan-2-amine;hydrochloride
CID 120851606

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine?
The IUPAC name of 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine (CID 120851603) is 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine.
What is the SMILES notation for 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine?
The canonical SMILES for 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine is Fc1cccc(F)c1C1CCN(CC2CCNCC2)CC1.
What is the InChIKey of 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine?
The InChIKey is USDQXRNIQACZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F2N2/c18-15-2-1-3-16(19)17(15)14-6-10-21(11-7-14)12-13-4-8-20-9-5-13/h1-3,13-14,20H,4-12H2.
What are the key properties of 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine?
4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine has a molecular weight of 294.39 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine is sourced from PubChem (CID 120851603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).