2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide

C8H18N4O — CID 83021762

IUPAC2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide
SMILESCNCC(=O)NN1CCN(C)CC1
InChIInChI=1S/C8H18N4O/c1-9-7-8(13)10-12-5-3-11(2)4-6-12/h9H,3-7H2,1-2H3,(H,10,13)
InChIKeyRSWCGTGRMJVGRC-UHFFFAOYSA-N
MW186.26 g/mol
LogP-1.52
Rot. Bonds3

About 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide

2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide (PubChem CID 83021762) has the molecular formula C8H18N4O and a molecular weight of 186.26 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide
PubChem CID83021762
Molecular FormulaC8H18N4O
Molecular Weight186.26 g/mol
Exact Mass186.15
IUPAC Name2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide
SMILESCNCC(=O)NN1CCN(C)CC1
InChIInChI=1S/C8H18N4O/c1-9-7-8(13)10-12-5-3-11(2)4-6-12/h9H,3-7H2,1-2H3,(H,10,13)
InChIKeyRSWCGTGRMJVGRC-UHFFFAOYSA-N
XLogP-1.52
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 5-1.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide?
The IUPAC name of 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide (CID 83021762) is 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide is CNCC(=O)NN1CCN(C)CC1.
What is the InChIKey of 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide?
The InChIKey is RSWCGTGRMJVGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O/c1-9-7-8(13)10-12-5-3-11(2)4-6-12/h9H,3-7H2,1-2H3,(H,10,13).
What are the key properties of 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide?
2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide has a molecular weight of 186.26 g/mol, XLogP of -1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-methylpiperazin-1-yl)acetamide is sourced from PubChem (CID 83021762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).