N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide

C12H22N4O2 — CID 56711685

IUPACN-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide
SMILESCNC(=O)CC1C(=O)NCCN1C1CCNCC1
InChIInChI=1S/C12H22N4O2/c1-13-11(17)8-10-12(18)15-6-7-16(10)9-2-4-14-5-3-9/h9-10,14H,2-8H2,1H3,(H,13,17)(H,15,18)
InChIKeyQFOLVIKJIGISHC-UHFFFAOYSA-N
MW254.33 g/mol
LogP-1.33
Rot. Bonds3

About N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide

N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide (PubChem CID 56711685) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide
PubChem CID56711685
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide
SMILESCNC(=O)CC1C(=O)NCCN1C1CCNCC1
InChIInChI=1S/C12H22N4O2/c1-13-11(17)8-10-12(18)15-6-7-16(10)9-2-4-14-5-3-9/h9-10,14H,2-8H2,1H3,(H,13,17)(H,15,18)
InChIKeyQFOLVIKJIGISHC-UHFFFAOYSA-N
XLogP-1.33
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-1.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide?
The IUPAC name of N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide (CID 56711685) is N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide.
What is the SMILES notation for N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide?
The canonical SMILES for N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide is CNC(=O)CC1C(=O)NCCN1C1CCNCC1.
What is the InChIKey of N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide?
The InChIKey is QFOLVIKJIGISHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-13-11(17)8-10-12(18)15-6-7-16(10)9-2-4-14-5-3-9/h9-10,14H,2-8H2,1H3,(H,13,17)(H,15,18).
What are the key properties of N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide?
N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide has a molecular weight of 254.33 g/mol, XLogP of -1.33, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-oxo-1-piperidin-4-ylpiperazin-2-yl)acetamide is sourced from PubChem (CID 56711685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).