1-(6-pentyl-2-pyridinyl)piperazine

C14H23N3 — CID 14570957

IUPAC1-(6-pentyl-2-pyridinyl)piperazine
SMILESCCCCCc1cccc(N2CCNCC2)n1
InChIInChI=1S/C14H23N3/c1-2-3-4-6-13-7-5-8-14(16-13)17-11-9-15-10-12-17/h5,7-8,15H,2-4,6,9-12H2,1H3
InChIKeyDXBNUYWPOGAZRC-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.22
Rot. Bonds5

About 1-(6-pentyl-2-pyridinyl)piperazine

1-(6-pentyl-2-pyridinyl)piperazine (PubChem CID 14570957) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(6-pentyl-2-pyridinyl)piperazine.

Molecular Properties

Compound Name1-(6-pentyl-2-pyridinyl)piperazine
PubChem CID14570957
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-(6-pentyl-2-pyridinyl)piperazine
SMILESCCCCCc1cccc(N2CCNCC2)n1
InChIInChI=1S/C14H23N3/c1-2-3-4-6-13-7-5-8-14(16-13)17-11-9-15-10-12-17/h5,7-8,15H,2-4,6,9-12H2,1H3
InChIKeyDXBNUYWPOGAZRC-UHFFFAOYSA-N
XLogP2.22
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(6-pentyl-2-pyridinyl)piperazine?
The IUPAC name of 1-(6-pentyl-2-pyridinyl)piperazine (CID 14570957) is 1-(6-pentyl-2-pyridinyl)piperazine.
What is the SMILES notation for 1-(6-pentyl-2-pyridinyl)piperazine?
The canonical SMILES for 1-(6-pentyl-2-pyridinyl)piperazine is CCCCCc1cccc(N2CCNCC2)n1.
What is the InChIKey of 1-(6-pentyl-2-pyridinyl)piperazine?
The InChIKey is DXBNUYWPOGAZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-3-4-6-13-7-5-8-14(16-13)17-11-9-15-10-12-17/h5,7-8,15H,2-4,6,9-12H2,1H3.
What are the key properties of 1-(6-pentyl-2-pyridinyl)piperazine?
1-(6-pentyl-2-pyridinyl)piperazine has a molecular weight of 233.36 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-pentyl-2-pyridinyl)piperazine is sourced from PubChem (CID 14570957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).