1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one

C14H17N5O — CID 133490452

IUPAC1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one
SMILESCc1cc(N2CCN(c3cnn(C)c3)C(=O)C2)ccn1
InChIInChI=1S/C14H17N5O/c1-11-7-12(3-4-15-11)18-5-6-19(14(20)10-18)13-8-16-17(2)9-13/h3-4,7-9H,5-6,10H2,1-2H3
InChIKeyKORXNSPZQZEVEI-UHFFFAOYSA-N
MW271.32 g/mol
LogP0.98
Rot. Bonds2

About 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one

1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one (PubChem CID 133490452) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one.

Molecular Properties

Compound Name1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one
PubChem CID133490452
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one
SMILESCc1cc(N2CCN(c3cnn(C)c3)C(=O)C2)ccn1
InChIInChI=1S/C14H17N5O/c1-11-7-12(3-4-15-11)18-5-6-19(14(20)10-18)13-8-16-17(2)9-13/h3-4,7-9H,5-6,10H2,1-2H3
InChIKeyKORXNSPZQZEVEI-UHFFFAOYSA-N
XLogP0.98
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4,6-dimethylpyrimidin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 71976819
4-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]benzonitrile
CID 133336956
4-(6-bromoquinolin-4-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 133336896
4-[2-(methoxymethyl)-6-methylpyrimidin-4-yl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 133336876
1-(1-methylpyrazol-4-yl)-4-(6-methylquinazolin-4-yl)piperazin-2-one
CID 133336905
1-(1-methylpyrazol-4-yl)-4-(3-methylquinoxalin-2-yl)piperazin-2-one
CID 133336819
5-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyrazine-2-carboxylic acid
CID 122054198
1-(1-methylpyrazol-4-yl)-4-(3-propan-2-yloxypyrazin-2-yl)piperazin-2-one
CID 133455216
4-[4-(4-fluorophenoxy)pyrimidin-2-yl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 133336871
1-(1-methylpyrazol-4-yl)-4-(7H-purin-6-yl)piperazin-2-one
CID 133336935
1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
CID 70517179
4-chloro-2-methyl-5-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]pyridazin-3-one
CID 133336960

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one?
The IUPAC name of 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one (CID 133490452) is 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one.
What is the SMILES notation for 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one?
The canonical SMILES for 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one is Cc1cc(N2CCN(c3cnn(C)c3)C(=O)C2)ccn1.
What is the InChIKey of 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one?
The InChIKey is KORXNSPZQZEVEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-11-7-12(3-4-15-11)18-5-6-19(14(20)10-18)13-8-16-17(2)9-13/h3-4,7-9H,5-6,10H2,1-2H3.
What are the key properties of 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one?
1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one has a molecular weight of 271.32 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazol-4-yl)-4-(2-methyl-4-pyridinyl)piperazin-2-one is sourced from PubChem (CID 133490452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).