piperazine-1-carboxamide;zinc

C5H11N3OZn — CID 175213463

IUPACpiperazine-1-carboxamide;zinc
SMILESNC(=O)N1CCNCC1.[Zn]
InChIInChI=1S/C5H11N3O.Zn/c6-5(9)8-3-1-7-2-4-8;/h7H,1-4H2,(H2,6,9);
InChIKeyLWVOEIZADZUPIO-UHFFFAOYSA-N
MW194.55 g/mol
LogP-1.03
Rot. Bonds

About piperazine-1-carboxamide;zinc

piperazine-1-carboxamide;zinc (PubChem CID 175213463) has the molecular formula C5H11N3OZn and a molecular weight of 194.55 g/mol. Its IUPAC name is piperazine-1-carboxamide;zinc.

Molecular Properties

Compound Namepiperazine-1-carboxamide;zinc
PubChem CID175213463
Molecular FormulaC5H11N3OZn
Molecular Weight194.55 g/mol
Exact Mass193.02
IUPAC Namepiperazine-1-carboxamide;zinc
SMILESNC(=O)N1CCNCC1.[Zn]
InChIInChI=1S/C5H11N3O.Zn/c6-5(9)8-3-1-7-2-4-8;/h7H,1-4H2,(H2,6,9);
InChIKeyLWVOEIZADZUPIO-UHFFFAOYSA-N
XLogP-1.03
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.55
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 175214786
4-hydroxypiperidine-1-carboxamide;piperidin-4-ol
CID 158744315
piperazine-1-carbothioic S-acid
CID 22219896
2-oxo-2-piperazin-1-ylacetic acid
CID 2050152
1-(azetidin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 130547937
(E)-1,4-di(piperazin-1-yl)but-2-ene-1,4-dione
CID 141152573
ethene;1-piperazin-1-ylethanone
CID 145071339
ethane;pyrrolidine-1-carboxamide
CID 144643607
lithium;hydride;pyrrolidine-1-carboxamide
CID 173065228
azepan-1-yl(piperazin-1-yl)methanone;hydrochloride
CID 2992287

Frequently Asked Questions

What is the IUPAC name of piperazine-1-carboxamide;zinc?
The IUPAC name of piperazine-1-carboxamide;zinc (CID 175213463) is piperazine-1-carboxamide;zinc.
What is the SMILES notation for piperazine-1-carboxamide;zinc?
The canonical SMILES for piperazine-1-carboxamide;zinc is NC(=O)N1CCNCC1.[Zn].
What is the InChIKey of piperazine-1-carboxamide;zinc?
The InChIKey is LWVOEIZADZUPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O.Zn/c6-5(9)8-3-1-7-2-4-8;/h7H,1-4H2,(H2,6,9);.
What are the key properties of piperazine-1-carboxamide;zinc?
piperazine-1-carboxamide;zinc has a molecular weight of 194.55 g/mol, XLogP of -1.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine-1-carboxamide;zinc is sourced from PubChem (CID 175213463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).