N-acetyl-2-piperazin-1-ylacetamide

C8H15N3O2 — CID 67050352

IUPACN-acetyl-2-piperazin-1-ylacetamide
SMILESCC(=O)NC(=O)CN1CCNCC1
InChIInChI=1S/C8H15N3O2/c1-7(12)10-8(13)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13)
InChIKeyVHGVUUZWUOGFIX-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.45
Rot. Bonds2

About N-acetyl-2-piperazin-1-ylacetamide

N-acetyl-2-piperazin-1-ylacetamide (PubChem CID 67050352) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is N-acetyl-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-acetyl-2-piperazin-1-ylacetamide
PubChem CID67050352
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC NameN-acetyl-2-piperazin-1-ylacetamide
SMILESCC(=O)NC(=O)CN1CCNCC1
InChIInChI=1S/C8H15N3O2/c1-7(12)10-8(13)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13)
InChIKeyVHGVUUZWUOGFIX-UHFFFAOYSA-N
XLogP-1.45
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-piperazin-1-ylacetamide?
The IUPAC name of N-acetyl-2-piperazin-1-ylacetamide (CID 67050352) is N-acetyl-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-acetyl-2-piperazin-1-ylacetamide?
The canonical SMILES for N-acetyl-2-piperazin-1-ylacetamide is CC(=O)NC(=O)CN1CCNCC1.
What is the InChIKey of N-acetyl-2-piperazin-1-ylacetamide?
The InChIKey is VHGVUUZWUOGFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-7(12)10-8(13)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13).
What are the key properties of N-acetyl-2-piperazin-1-ylacetamide?
N-acetyl-2-piperazin-1-ylacetamide has a molecular weight of 185.23 g/mol, XLogP of -1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-piperazin-1-ylacetamide is sourced from PubChem (CID 67050352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).