2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole

C14H19N5S — CID 39817822

IUPAC2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole
SMILESCc1nc(C)c(CN2CCN(c3cnccn3)CC2)s1
InChIInChI=1S/C14H19N5S/c1-11-13(20-12(2)17-11)10-18-5-7-19(8-6-18)14-9-15-3-4-16-14/h3-4,9H,5-8,10H2,1-2H3
InChIKeyIGPUAEZQVCVPOL-UHFFFAOYSA-N
MW289.41 g/mol
LogP1.87
Rot. Bonds3

About 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole

2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole (PubChem CID 39817822) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole.

Molecular Properties

Compound Name2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole
PubChem CID39817822
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole
SMILESCc1nc(C)c(CN2CCN(c3cnccn3)CC2)s1
InChIInChI=1S/C14H19N5S/c1-11-13(20-12(2)17-11)10-18-5-7-19(8-6-18)14-9-15-3-4-16-14/h3-4,9H,5-8,10H2,1-2H3
InChIKeyIGPUAEZQVCVPOL-UHFFFAOYSA-N
XLogP1.87
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole 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-Methyl-2-[2-methyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]-1,3-thiazole
CID 53620824
2-{4-[(2,4-Dimethyl-1,3-thiazol-5-yl)methyl]-1-piperazinyl}pyrimidine
CID 29085213
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-3,6-dimethylpyrazin-2-amine
CID 91651070
2-[(3S)-1-(3,6-dimethylpyrazin-2-yl)piperidin-3-yl]-5-methyl-1,3-thiazole
CID 124296068
5-[[4-[[1-(Difluoromethyl)imidazol-2-yl]methyl]piperazin-1-yl]methyl]-2,4-dimethyl-1,3-thiazole
CID 71972868
3-[[(2S,4S)-4-fluoro-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methyl-methylamino]pyrazine-2-carbonitrile
CID 128970808
3-Fluoro-n-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine
CID 164657187
1-[(2,4-Dimethyl-1,3-thiazol-5-yl)methyl]-4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]piperazine
CID 166605271
3-(4-{[4-(Trifluoromethyl)-1,3-thiazol-2-yl]methyl}piperazin-1-yl)pyrazine-2-carbonitrile
CID 171333834
N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyrazin-2-amine
CID 57833991
2-Chloro-4-[4-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]-5-methyl-1,3-thiazole
CID 58074994
2-Chloro-5-methyl-4-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-thiazole
CID 58075121

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole?
The IUPAC name of 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole (CID 39817822) is 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole.
What is the SMILES notation for 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole?
The canonical SMILES for 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole is Cc1nc(C)c(CN2CCN(c3cnccn3)CC2)s1.
What is the InChIKey of 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole?
The InChIKey is IGPUAEZQVCVPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-11-13(20-12(2)17-11)10-18-5-7-19(8-6-18)14-9-15-3-4-16-14/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole?
2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole has a molecular weight of 289.41 g/mol, XLogP of 1.87, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,3-thiazole is sourced from PubChem (CID 39817822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).