6-methyl-3-(methylaminomethyl)piperazin-2-one

C7H15N3O — CID 171531095

IUPAC6-methyl-3-(methylaminomethyl)piperazin-2-one
SMILESCNCC1NCC(C)NC1=O
InChIInChI=1S/C7H15N3O/c1-5-3-9-6(4-8-2)7(11)10-5/h5-6,8-9H,3-4H2,1-2H3,(H,10,11)
InChIKeyGGFLPSDTHHZRRB-UHFFFAOYSA-N
MW157.22 g/mol
LogP-1.32
Rot. Bonds2

About 6-methyl-3-(methylaminomethyl)piperazin-2-one

6-methyl-3-(methylaminomethyl)piperazin-2-one (PubChem CID 171531095) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 6-methyl-3-(methylaminomethyl)piperazin-2-one.

Molecular Properties

Compound Name6-methyl-3-(methylaminomethyl)piperazin-2-one
PubChem CID171531095
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name6-methyl-3-(methylaminomethyl)piperazin-2-one
SMILESCNCC1NCC(C)NC1=O
InChIInChI=1S/C7H15N3O/c1-5-3-9-6(4-8-2)7(11)10-5/h5-6,8-9H,3-4H2,1-2H3,(H,10,11)
InChIKeyGGFLPSDTHHZRRB-UHFFFAOYSA-N
XLogP-1.32
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-1.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(methylaminomethyl)piperazin-2-one?
The IUPAC name of 6-methyl-3-(methylaminomethyl)piperazin-2-one (CID 171531095) is 6-methyl-3-(methylaminomethyl)piperazin-2-one.
What is the SMILES notation for 6-methyl-3-(methylaminomethyl)piperazin-2-one?
The canonical SMILES for 6-methyl-3-(methylaminomethyl)piperazin-2-one is CNCC1NCC(C)NC1=O.
What is the InChIKey of 6-methyl-3-(methylaminomethyl)piperazin-2-one?
The InChIKey is GGFLPSDTHHZRRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-5-3-9-6(4-8-2)7(11)10-5/h5-6,8-9H,3-4H2,1-2H3,(H,10,11).
What are the key properties of 6-methyl-3-(methylaminomethyl)piperazin-2-one?
6-methyl-3-(methylaminomethyl)piperazin-2-one has a molecular weight of 157.22 g/mol, XLogP of -1.32, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(methylaminomethyl)piperazin-2-one is sourced from PubChem (CID 171531095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).