1-[(4-fluoropiperidin-4-yl)methyl]piperazine

C10H20FN3 — CID 165138040

IUPAC1-[(4-fluoropiperidin-4-yl)methyl]piperazine
SMILESFC1(CN2CCNCC2)CCNCC1
InChIInChI=1S/C10H20FN3/c11-10(1-3-12-4-2-10)9-14-7-5-13-6-8-14/h12-13H,1-9H2
InChIKeyPKXQFWFCJRUCKL-UHFFFAOYSA-N
MW201.29 g/mol
LogP-0.02
Rot. Bonds2

About 1-[(4-fluoropiperidin-4-yl)methyl]piperazine

1-[(4-fluoropiperidin-4-yl)methyl]piperazine (PubChem CID 165138040) has the molecular formula C10H20FN3 and a molecular weight of 201.29 g/mol. Its IUPAC name is 1-[(4-fluoropiperidin-4-yl)methyl]piperazine.

Molecular Properties

Compound Name1-[(4-fluoropiperidin-4-yl)methyl]piperazine
PubChem CID165138040
Molecular FormulaC10H20FN3
Molecular Weight201.29 g/mol
Exact Mass201.16
IUPAC Name1-[(4-fluoropiperidin-4-yl)methyl]piperazine
SMILESFC1(CN2CCNCC2)CCNCC1
InChIInChI=1S/C10H20FN3/c11-10(1-3-12-4-2-10)9-14-7-5-13-6-8-14/h12-13H,1-9H2
InChIKeyPKXQFWFCJRUCKL-UHFFFAOYSA-N
XLogP-0.02
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-4-(piperidin-4-ylmethyl)piperazine
CID 23391792
1-Methyl-4-[2-(piperidin-4-yl)ethyl]piperazine
CID 4778264
1-((1-Methyl-4-piperidinyl)methyl)piperazine
CID 2736942
1-(2-Piperidin-1-yl-ethyl)-piperazine
CID 2737212
1-(3-Piperidinopropyl)piperazine
CID 2737253
1-(Piperidin-4-ylmethyl)piperidine
CID 12802905
1-(2-(Piperidin-4-yl)ethyl)piperidine
CID 296292
1-Ethyl-4-(piperidin-4-ylmethyl)piperazine
CID 22689741
1-Methyl-4-(1-piperidin-4-ylethyl)piperazine
CID 44827668
1-Methyl-4-((4-methylpiperidin-4-yl)methyl)piperazine
CID 63123006
1,4,9-Triazaspiro[5.5]undecane
CID 21926517
2-Fluoro-1-piperidin-3-ylpiperidine
CID 57315210

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluoropiperidin-4-yl)methyl]piperazine?
The IUPAC name of 1-[(4-fluoropiperidin-4-yl)methyl]piperazine (CID 165138040) is 1-[(4-fluoropiperidin-4-yl)methyl]piperazine.
What is the SMILES notation for 1-[(4-fluoropiperidin-4-yl)methyl]piperazine?
The canonical SMILES for 1-[(4-fluoropiperidin-4-yl)methyl]piperazine is FC1(CN2CCNCC2)CCNCC1.
What is the InChIKey of 1-[(4-fluoropiperidin-4-yl)methyl]piperazine?
The InChIKey is PKXQFWFCJRUCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN3/c11-10(1-3-12-4-2-10)9-14-7-5-13-6-8-14/h12-13H,1-9H2.
What are the key properties of 1-[(4-fluoropiperidin-4-yl)methyl]piperazine?
1-[(4-fluoropiperidin-4-yl)methyl]piperazine has a molecular weight of 201.29 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluoropiperidin-4-yl)methyl]piperazine is sourced from PubChem (CID 165138040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).