1-cyclopentylpiperazine;4,4-difluoropiperidine

C14H27F2N3 — CID 67269191

IUPAC1-cyclopentylpiperazine;4,4-difluoropiperidine
SMILESC1CCC(N2CCNCC2)C1.FC1(F)CCNCC1
InChIInChI=1S/C9H18N2.C5H9F2N/c1-2-4-9(3-1)11-7-5-10-6-8-11;6-5(7)1-3-8-4-2-5/h9-10H,1-8H2;8H,1-4H2
InChIKeyBTUORSOAZZEDNT-UHFFFAOYSA-N
MW275.39 g/mol
LogP1.84
Rot. Bonds1

About 1-cyclopentylpiperazine;4,4-difluoropiperidine

1-cyclopentylpiperazine;4,4-difluoropiperidine (PubChem CID 67269191) has the molecular formula C14H27F2N3 and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-cyclopentylpiperazine;4,4-difluoropiperidine.

Molecular Properties

Compound Name1-cyclopentylpiperazine;4,4-difluoropiperidine
PubChem CID67269191
Molecular FormulaC14H27F2N3
Molecular Weight275.39 g/mol
Exact Mass275.22
IUPAC Name1-cyclopentylpiperazine;4,4-difluoropiperidine
SMILESC1CCC(N2CCNCC2)C1.FC1(F)CCNCC1
InChIInChI=1S/C9H18N2.C5H9F2N/c1-2-4-9(3-1)11-7-5-10-6-8-11;6-5(7)1-3-8-4-2-5/h9-10H,1-8H2;8H,1-4H2
InChIKeyBTUORSOAZZEDNT-UHFFFAOYSA-N
XLogP1.84
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylpiperazine;4,4-difluoropiperidine?
The IUPAC name of 1-cyclopentylpiperazine;4,4-difluoropiperidine (CID 67269191) is 1-cyclopentylpiperazine;4,4-difluoropiperidine.
What is the SMILES notation for 1-cyclopentylpiperazine;4,4-difluoropiperidine?
The canonical SMILES for 1-cyclopentylpiperazine;4,4-difluoropiperidine is C1CCC(N2CCNCC2)C1.FC1(F)CCNCC1.
What is the InChIKey of 1-cyclopentylpiperazine;4,4-difluoropiperidine?
The InChIKey is BTUORSOAZZEDNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.C5H9F2N/c1-2-4-9(3-1)11-7-5-10-6-8-11;6-5(7)1-3-8-4-2-5/h9-10H,1-8H2;8H,1-4H2.
What are the key properties of 1-cyclopentylpiperazine;4,4-difluoropiperidine?
1-cyclopentylpiperazine;4,4-difluoropiperidine has a molecular weight of 275.39 g/mol, XLogP of 1.84, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylpiperazine;4,4-difluoropiperidine is sourced from PubChem (CID 67269191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).