2,2-diethyl-1-pentyl-5-propylpiperazine

C16H34N2 — CID 64839985

IUPAC2,2-diethyl-1-pentyl-5-propylpiperazine
SMILESCCCCCN1CC(CCC)NCC1(CC)CC
InChIInChI=1S/C16H34N2/c1-5-9-10-12-18-13-15(11-6-2)17-14-16(18,7-3)8-4/h15,17H,5-14H2,1-4H3
InChIKeyCNHZGDYAHIEPNT-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.81
Rot. Bonds8

About 2,2-diethyl-1-pentyl-5-propylpiperazine

2,2-diethyl-1-pentyl-5-propylpiperazine (PubChem CID 64839985) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2,2-diethyl-1-pentyl-5-propylpiperazine.

Molecular Properties

Compound Name2,2-diethyl-1-pentyl-5-propylpiperazine
PubChem CID64839985
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2,2-diethyl-1-pentyl-5-propylpiperazine
SMILESCCCCCN1CC(CCC)NCC1(CC)CC
InChIInChI=1S/C16H34N2/c1-5-9-10-12-18-13-15(11-6-2)17-14-16(18,7-3)8-4/h15,17H,5-14H2,1-4H3
InChIKeyCNHZGDYAHIEPNT-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 2,2-diethyl-1-pentyl-5-propylpiperazine?
The IUPAC name of 2,2-diethyl-1-pentyl-5-propylpiperazine (CID 64839985) is 2,2-diethyl-1-pentyl-5-propylpiperazine.
What is the SMILES notation for 2,2-diethyl-1-pentyl-5-propylpiperazine?
The canonical SMILES for 2,2-diethyl-1-pentyl-5-propylpiperazine is CCCCCN1CC(CCC)NCC1(CC)CC.
What is the InChIKey of 2,2-diethyl-1-pentyl-5-propylpiperazine?
The InChIKey is CNHZGDYAHIEPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-5-9-10-12-18-13-15(11-6-2)17-14-16(18,7-3)8-4/h15,17H,5-14H2,1-4H3.
What are the key properties of 2,2-diethyl-1-pentyl-5-propylpiperazine?
2,2-diethyl-1-pentyl-5-propylpiperazine has a molecular weight of 254.46 g/mol, XLogP of 3.81, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-1-pentyl-5-propylpiperazine is sourced from PubChem (CID 64839985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).