formamide;piperazine

C5H13N3O — CID 6713365

IUPACformamide;piperazine
SMILESC1CNCCN1.NC=O
InChIInChI=1S/C4H10N2.CH3NO/c1-2-6-4-3-5-1;2-1-3/h5-6H,1-4H2;1H,(H2,2,3)
InChIKeyIUIZUEPFPGZJBW-UHFFFAOYSA-N
MW131.18 g/mol
LogP-1.72
Rot. Bonds

About formamide;piperazine

formamide;piperazine (PubChem CID 6713365) has the molecular formula C5H13N3O and a molecular weight of 131.18 g/mol. Its IUPAC name is formamide;piperazine.

Molecular Properties

Compound Nameformamide;piperazine
PubChem CID6713365
Molecular FormulaC5H13N3O
Molecular Weight131.18 g/mol
Exact Mass131.11
IUPAC Nameformamide;piperazine
SMILESC1CNCCN1.NC=O
InChIInChI=1S/C4H10N2.CH3NO/c1-2-6-4-3-5-1;2-1-3/h5-6H,1-4H2;1H,(H2,2,3)
InChIKeyIUIZUEPFPGZJBW-UHFFFAOYSA-N
XLogP-1.72
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-1.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of formamide;piperazine?
The IUPAC name of formamide;piperazine (CID 6713365) is formamide;piperazine.
What is the SMILES notation for formamide;piperazine?
The canonical SMILES for formamide;piperazine is C1CNCCN1.NC=O.
What is the InChIKey of formamide;piperazine?
The InChIKey is IUIZUEPFPGZJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.CH3NO/c1-2-6-4-3-5-1;2-1-3/h5-6H,1-4H2;1H,(H2,2,3).
What are the key properties of formamide;piperazine?
formamide;piperazine has a molecular weight of 131.18 g/mol, XLogP of -1.72, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;piperazine is sourced from PubChem (CID 6713365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).