4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one

C10H16N4O — CID 135505922

IUPAC4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(N2CCN(C)CC2)n1
InChIInChI=1S/C10H16N4O/c1-8-7-9(15)12-10(11-8)14-5-3-13(2)4-6-14/h7H,3-6H2,1-2H3,(H,11,12,15)
InChIKeyQBVNVDXDYGVFOZ-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.17
Rot. Bonds1

About 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one

4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one (PubChem CID 135505922) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one
PubChem CID135505922
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(N2CCN(C)CC2)n1
InChIInChI=1S/C10H16N4O/c1-8-7-9(15)12-10(11-8)14-5-3-13(2)4-6-14/h7H,3-6H2,1-2H3,(H,11,12,15)
InChIKeyQBVNVDXDYGVFOZ-UHFFFAOYSA-N
XLogP-0.17
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one 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 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one?
The IUPAC name of 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one (CID 135505922) is 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one is Cc1cc(=O)[nH]c(N2CCN(C)CC2)n1.
What is the InChIKey of 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one?
The InChIKey is QBVNVDXDYGVFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-8-7-9(15)12-10(11-8)14-5-3-13(2)4-6-14/h7H,3-6H2,1-2H3,(H,11,12,15).
What are the key properties of 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one?
4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one has a molecular weight of 208.26 g/mol, XLogP of -0.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 135505922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).