2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one

C10H16N4O — CID 79659297

IUPAC2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one
SMILESCN1CCN(C)C(c2nccc(=O)[nH]2)C1
InChIInChI=1S/C10H16N4O/c1-13-5-6-14(2)8(7-13)10-11-4-3-9(15)12-10/h3-4,8H,5-7H2,1-2H3,(H,11,12,15)
InChIKeyUZOGZHGHIJSDBN-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.31
Rot. Bonds1

About 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one

2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one (PubChem CID 79659297) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one
PubChem CID79659297
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one
SMILESCN1CCN(C)C(c2nccc(=O)[nH]2)C1
InChIInChI=1S/C10H16N4O/c1-13-5-6-14(2)8(7-13)10-11-4-3-9(15)12-10/h3-4,8H,5-7H2,1-2H3,(H,11,12,15)
InChIKeyUZOGZHGHIJSDBN-UHFFFAOYSA-N
XLogP-0.31
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 ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,4-diazabicyclo[2.2.2]octan-2-yl)-1H-pyrimidin-6-one
CID 79970436
[2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]methanamine
CID 79666220
2-(1,4-dimethylpiperazin-2-yl)-5-ethyl-4-hydroxy-1H-pyrimidin-6-one
CID 79658713
2-(3-ethylcyclopentyl)-1H-pyrimidin-6-one
CID 65407142
N-[2-(1,4-dimethylpiperazin-2-yl)-1H-benzimidazol-4-yl]formamide
CID 57177667
2-(1,4-dimethylpiperazin-2-yl)-5,6,7,8-tetrahydro-1H-quinazoline-4-thione
CID 106477168
1,4-dimethyl-2-phenylpiperazine;hydroiodide
CID 168921950
2-(1,4-dimethylpiperazin-2-yl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidine-4-thione
CID 106482720
1,4-dimethyl-2-(1-methylpyrazol-4-yl)piperazine
CID 177188988
5-[(3S)-3-(1H-imidazol-2-yl)-4-methylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CID 129337331
(2R)-2-(1H-imidazol-2-yl)-1-methyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine
CID 129338621
(2S)-4-(2-bromophenyl)sulfonyl-2-(1H-imidazol-2-yl)-1-methylpiperazine
CID 129330517

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one?
The IUPAC name of 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one (CID 79659297) is 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one is CN1CCN(C)C(c2nccc(=O)[nH]2)C1.
What is the InChIKey of 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one?
The InChIKey is UZOGZHGHIJSDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-5-6-14(2)8(7-13)10-11-4-3-9(15)12-10/h3-4,8H,5-7H2,1-2H3,(H,11,12,15).
What are the key properties of 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one?
2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one has a molecular weight of 208.26 g/mol, XLogP of -0.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dimethylpiperazin-2-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 79659297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).