piperazine;pentakis(piperidine-2,5-dione)

C41H75N13O10 — CID 159815565

IUPACpiperazine;pentakis(piperidine-2,5-dione)
SMILESC1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1
InChIInChI=1S/5C5H7NO2.4C4H10N2/c5*7-4-1-2-5(8)6-3-4;4*1-2-6-4-3-5-1/h5*1-3H2,(H,6,8);4*5-6H,1-4H2
InChIKeyNLONXXVGQFYGFH-UHFFFAOYSA-N
MW910.13 g/mol
LogP-5.96
Rot. Bonds

About piperazine;pentakis(piperidine-2,5-dione)

piperazine;pentakis(piperidine-2,5-dione) (PubChem CID 159815565) has the molecular formula C41H75N13O10 and a molecular weight of 910.13 g/mol. Its IUPAC name is piperazine;pentakis(piperidine-2,5-dione).

Molecular Properties

Compound Namepiperazine;pentakis(piperidine-2,5-dione)
PubChem CID159815565
Molecular FormulaC41H75N13O10
Molecular Weight910.13 g/mol
Exact Mass909.58
IUPAC Namepiperazine;pentakis(piperidine-2,5-dione)
SMILESC1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1
InChIInChI=1S/5C5H7NO2.4C4H10N2/c5*7-4-1-2-5(8)6-3-4;4*1-2-6-4-3-5-1/h5*1-3H2,(H,6,8);4*5-6H,1-4H2
InChIKeyNLONXXVGQFYGFH-UHFFFAOYSA-N
XLogP-5.96
TPSA327.09 Ų
H-Bond Donors13
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms64
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500910.13
LogP ≤ 5-5.96
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1018

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Related Compounds

CID 158947249
CID 158947249
Methane;nonakis(1-[4-[2-(4-methylpiperazin-1-yl)acetyl]piperazin-1-yl]pentane-1,4-dione)
CID 158947743
1-Amino-3-methylbutan-2-one;1-amino-4-methylpentan-3-one;methane;3-methyl-1-piperazin-1-ylbutan-1-one;3-methyl-1-piperazin-1-ylbutan-2-one;4-methyl-1-piperazin-1-ylpentan-1-one;4-methyl-1-piperazin-1-ylpentan-3-one;bis(2-methyl-1-piperazin-1-ylpropan-1-one)
CID 161006480
1-Amino-3-methylbutan-2-one;1-amino-4-methylpentan-3-one;3-methyl-1-piperazin-1-ylbutan-1-one;3-methyl-1-piperazin-1-ylbutan-2-one;4-methyl-1-piperazin-1-ylpentan-1-one;4-methyl-1-piperazin-1-ylpentan-3-one;bis(2-methyl-1-piperazin-1-ylpropan-1-one)
CID 161016065
2-(4-Methylpiperazin-1-yl)-1-piperazin-1-ylethanone;hexakis(2-(4-methylpiperazin-1-yl)-1-piperidin-1-ylethanone)
CID 162077646

Frequently Asked Questions

What is the IUPAC name of piperazine;pentakis(piperidine-2,5-dione)?
The IUPAC name of piperazine;pentakis(piperidine-2,5-dione) (CID 159815565) is piperazine;pentakis(piperidine-2,5-dione).
What is the SMILES notation for piperazine;pentakis(piperidine-2,5-dione)?
The canonical SMILES for piperazine;pentakis(piperidine-2,5-dione) is C1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.O=C1CCC(=O)NC1.
What is the InChIKey of piperazine;pentakis(piperidine-2,5-dione)?
The InChIKey is NLONXXVGQFYGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/5C5H7NO2.4C4H10N2/c5*7-4-1-2-5(8)6-3-4;4*1-2-6-4-3-5-1/h5*1-3H2,(H,6,8);4*5-6H,1-4H2.
What are the key properties of piperazine;pentakis(piperidine-2,5-dione)?
piperazine;pentakis(piperidine-2,5-dione) has a molecular weight of 910.13 g/mol, XLogP of -5.96, 0 rotatable bonds, 13 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;pentakis(piperidine-2,5-dione) is sourced from PubChem (CID 159815565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).