piperazin-2-one;piperidine

C9H19N3O — CID 158689813

IUPACpiperazin-2-one;piperidine
SMILESC1CCNCC1.O=C1CNCCN1
InChIInChI=1S/C5H11N.C4H8N2O/c1-2-4-6-5-3-1;7-4-3-5-1-2-6-4/h6H,1-5H2;5H,1-3H2,(H,6,7)
InChIKeyIGEXALWCQRXUQQ-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.53
Rot. Bonds

About piperazin-2-one;piperidine

piperazin-2-one;piperidine (PubChem CID 158689813) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is piperazin-2-one;piperidine.

Molecular Properties

Compound Namepiperazin-2-one;piperidine
PubChem CID158689813
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Namepiperazin-2-one;piperidine
SMILESC1CCNCC1.O=C1CNCCN1
InChIInChI=1S/C5H11N.C4H8N2O/c1-2-4-6-5-3-1;7-4-3-5-1-2-6-4/h6H,1-5H2;5H,1-3H2,(H,6,7)
InChIKeyIGEXALWCQRXUQQ-UHFFFAOYSA-N
XLogP-0.53
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of piperazin-2-one;piperidine?
The IUPAC name of piperazin-2-one;piperidine (CID 158689813) is piperazin-2-one;piperidine.
What is the SMILES notation for piperazin-2-one;piperidine?
The canonical SMILES for piperazin-2-one;piperidine is C1CCNCC1.O=C1CNCCN1.
What is the InChIKey of piperazin-2-one;piperidine?
The InChIKey is IGEXALWCQRXUQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.C4H8N2O/c1-2-4-6-5-3-1;7-4-3-5-1-2-6-4/h6H,1-5H2;5H,1-3H2,(H,6,7).
What are the key properties of piperazin-2-one;piperidine?
piperazin-2-one;piperidine has a molecular weight of 185.27 g/mol, XLogP of -0.53, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperazin-2-one;piperidine is sourced from PubChem (CID 158689813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).