piperazine;prop-2-enamide

C11H25N5O — CID 18915240

IUPACpiperazine;prop-2-enamide
SMILESC1CNCCN1.C1CNCCN1.C=CC(N)=O
InChIInChI=1S/2C4H10N2.C3H5NO/c2*1-2-6-4-3-5-1;1-2-3(4)5/h2*5-6H,1-4H2;2H,1H2,(H2,4,5)
InChIKeyCCEQAIPWWBTLCL-UHFFFAOYSA-N
MW243.35 g/mol
LogP-1.98
Rot. Bonds1

About piperazine;prop-2-enamide

piperazine;prop-2-enamide (PubChem CID 18915240) has the molecular formula C11H25N5O and a molecular weight of 243.35 g/mol. Its IUPAC name is piperazine;prop-2-enamide.

Molecular Properties

Compound Namepiperazine;prop-2-enamide
PubChem CID18915240
Molecular FormulaC11H25N5O
Molecular Weight243.35 g/mol
Exact Mass243.21
IUPAC Namepiperazine;prop-2-enamide
SMILESC1CNCCN1.C1CNCCN1.C=CC(N)=O
InChIInChI=1S/2C4H10N2.C3H5NO/c2*1-2-6-4-3-5-1;1-2-3(4)5/h2*5-6H,1-4H2;2H,1H2,(H2,4,5)
InChIKeyCCEQAIPWWBTLCL-UHFFFAOYSA-N
XLogP-1.98
TPSA91.21 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-1.98
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze piperazine;prop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of piperazine;prop-2-enamide?
The IUPAC name of piperazine;prop-2-enamide (CID 18915240) is piperazine;prop-2-enamide.
What is the SMILES notation for piperazine;prop-2-enamide?
The canonical SMILES for piperazine;prop-2-enamide is C1CNCCN1.C1CNCCN1.C=CC(N)=O.
What is the InChIKey of piperazine;prop-2-enamide?
The InChIKey is CCEQAIPWWBTLCL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H10N2.C3H5NO/c2*1-2-6-4-3-5-1;1-2-3(4)5/h2*5-6H,1-4H2;2H,1H2,(H2,4,5).
What are the key properties of piperazine;prop-2-enamide?
piperazine;prop-2-enamide has a molecular weight of 243.35 g/mol, XLogP of -1.98, 1 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;prop-2-enamide is sourced from PubChem (CID 18915240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).