6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline

C18H25N3 — CID 64941343

IUPAC6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline
SMILESCCC1CNC(C)(CC)CN1c1ccc2ncccc2c1
InChIInChI=1S/C18H25N3/c1-4-15-12-20-18(3,5-2)13-21(15)16-8-9-17-14(11-16)7-6-10-19-17/h6-11,15,20H,4-5,12-13H2,1-3H3
InChIKeyZFQJZSZIBHVCAF-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.59
Rot. Bonds3

About 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline

6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline (PubChem CID 64941343) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline
PubChem CID64941343
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline
SMILESCCC1CNC(C)(CC)CN1c1ccc2ncccc2c1
InChIInChI=1S/C18H25N3/c1-4-15-12-20-18(3,5-2)13-21(15)16-8-9-17-14(11-16)7-6-10-19-17/h6-11,15,20H,4-5,12-13H2,1-3H3
InChIKeyZFQJZSZIBHVCAF-UHFFFAOYSA-N
XLogP3.59
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline?
The IUPAC name of 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline (CID 64941343) is 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline.
What is the SMILES notation for 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline?
The canonical SMILES for 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline is CCC1CNC(C)(CC)CN1c1ccc2ncccc2c1.
What is the InChIKey of 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline?
The InChIKey is ZFQJZSZIBHVCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-4-15-12-20-18(3,5-2)13-21(15)16-8-9-17-14(11-16)7-6-10-19-17/h6-11,15,20H,4-5,12-13H2,1-3H3.
What are the key properties of 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline?
6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline has a molecular weight of 283.42 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-diethyl-5-methylpiperazin-1-yl)quinoline is sourced from PubChem (CID 64941343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).