4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one

C10H16N4O — CID 135478199

IUPAC4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(N2CCNCC2)n1
InChIInChI=1S/C10H16N4O/c1-2-8-7-9(15)13-10(12-8)14-5-3-11-4-6-14/h7,11H,2-6H2,1H3,(H,12,13,15)
InChIKeyQAXLRUPNVVQPNM-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.26
Rot. Bonds2

About 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one

4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one (PubChem CID 135478199) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one
PubChem CID135478199
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(N2CCNCC2)n1
InChIInChI=1S/C10H16N4O/c1-2-8-7-9(15)13-10(12-8)14-5-3-11-4-6-14/h7,11H,2-6H2,1H3,(H,12,13,15)
InChIKeyQAXLRUPNVVQPNM-UHFFFAOYSA-N
XLogP-0.26
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one (CID 135478199) is 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one is CCc1cc(=O)[nH]c(N2CCNCC2)n1.
What is the InChIKey of 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one?
The InChIKey is QAXLRUPNVVQPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-8-7-9(15)13-10(12-8)14-5-3-11-4-6-14/h7,11H,2-6H2,1H3,(H,12,13,15).
What are the key properties of 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one?
4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one has a molecular weight of 208.26 g/mol, XLogP of -0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-piperazin-1-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 135478199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).