1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one

C15H20N6O2 — CID 133455216

IUPAC1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one
SMILESCC(C)Oc1nccnc1N1CCN(c2cnn(C)c2)C(=O)C1
InChIInChI=1S/C15H20N6O2/c1-11(2)23-15-14(16-4-5-17-15)20-6-7-21(13(22)10-20)12-8-18-19(3)9-12/h4-5,8-9,11H,6-7,10H2,1-3H3
InChIKeyRTVZKPTYFILAGY-UHFFFAOYSA-N
MW316.37 g/mol
LogP0.85
Rot. Bonds4

About 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one

1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one (PubChem CID 133455216) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one.

Molecular Properties

Compound Name1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one
PubChem CID133455216
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC Name1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one
SMILESCC(C)Oc1nccnc1N1CCN(c2cnn(C)c2)C(=O)C1
InChIInChI=1S/C15H20N6O2/c1-11(2)23-15-14(16-4-5-17-15)20-6-7-21(13(22)10-20)12-8-18-19(3)9-12/h4-5,8-9,11H,6-7,10H2,1-3H3
InChIKeyRTVZKPTYFILAGY-UHFFFAOYSA-N
XLogP0.85
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one
CID 133490452
1-(1-methylpyrazol-4-yl)-4-[(1S)-1-pyrazin-2-ylethyl]piperazin-2-one
CID 124617538
1-(1-methylpyrazol-4-yl)-4-(3-methylquinoxalin-2-yl)piperazin-2-one
CID 133336819
1-(1-methylpyrazol-4-yl)-4-(7H-purin-6-yl)piperazin-2-one
CID 133336935
4-(4,6-dimethylpyrimidin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 71976819
5-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyrazine-2-carboxylic acid
CID 122054198
1-(1-methylpyrazol-4-yl)-4-(6-methylquinazolin-4-yl)piperazin-2-one
CID 133336905
4-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]benzonitrile
CID 133336956
5,6-dimethyl-3-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyridazine-4-carbonitrile
CID 133336898
4-chloro-2-methyl-5-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyridazin-3-one
CID 133336960
4-(2-chloro-5-propan-2-yloxypyrimidin-4-yl)-1-phenylpiperazin-2-one
CID 171849392
1-(1-methylpyrazol-4-yl)-4-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-2-one
CID 133336812

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one?
The IUPAC name of 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one (CID 133455216) is 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one.
What is the SMILES notation for 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one?
The canonical SMILES for 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one is CC(C)Oc1nccnc1N1CCN(c2cnn(C)c2)C(=O)C1.
What is the InChIKey of 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one?
The InChIKey is RTVZKPTYFILAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-11(2)23-15-14(16-4-5-17-15)20-6-7-21(13(22)10-20)12-8-18-19(3)9-12/h4-5,8-9,11H,6-7,10H2,1-3H3.
What are the key properties of 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one?
1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one has a molecular weight of 316.37 g/mol, XLogP of 0.85, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one is sourced from PubChem (CID 133455216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).