1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one

C11H20N4O2 — CID 58735636

IUPAC1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one
SMILESCN1CCN(C(=O)CN2CCNCC2)CC1=O
InChIInChI=1S/C11H20N4O2/c1-13-6-7-15(9-10(13)16)11(17)8-14-4-2-12-3-5-14/h12H,2-9H2,1H3
InChIKeyQAKMDOUDGZULRV-UHFFFAOYSA-N
MW240.31 g/mol
LogP-1.81
Rot. Bonds2

About 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one

1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one (PubChem CID 58735636) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one.

Molecular Properties

Compound Name1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one
PubChem CID58735636
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one
SMILESCN1CCN(C(=O)CN2CCNCC2)CC1=O
InChIInChI=1S/C11H20N4O2/c1-13-6-7-15(9-10(13)16)11(17)8-14-4-2-12-3-5-14/h12H,2-9H2,1H3
InChIKeyQAKMDOUDGZULRV-UHFFFAOYSA-N
XLogP-1.81
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-1.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one?
The IUPAC name of 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one (CID 58735636) is 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one.
What is the SMILES notation for 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one?
The canonical SMILES for 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one is CN1CCN(C(=O)CN2CCNCC2)CC1=O.
What is the InChIKey of 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one?
The InChIKey is QAKMDOUDGZULRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-13-6-7-15(9-10(13)16)11(17)8-14-4-2-12-3-5-14/h12H,2-9H2,1H3.
What are the key properties of 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one?
1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one has a molecular weight of 240.31 g/mol, XLogP of -1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one is sourced from PubChem (CID 58735636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).