2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole

C15H18N6S — CID 56909140

IUPAC2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole
SMILESCCc1cc(N2CCN(c3nccs3)CC2)n2nccc2n1
InChIInChI=1S/C15H18N6S/c1-2-12-11-14(21-13(18-12)3-4-17-21)19-6-8-20(9-7-19)15-16-5-10-22-15/h3-5,10-11H,2,6-9H2,1H3
InChIKeyMOGRGNWJCVRCDX-UHFFFAOYSA-N
MW314.42 g/mol
LogP2.07
Rot. Bonds3

About 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole

2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole (PubChem CID 56909140) has the molecular formula C15H18N6S and a molecular weight of 314.42 g/mol. Its IUPAC name is 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole
PubChem CID56909140
Molecular FormulaC15H18N6S
Molecular Weight314.42 g/mol
Exact Mass314.13
IUPAC Name2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole
SMILESCCc1cc(N2CCN(c3nccs3)CC2)n2nccc2n1
InChIInChI=1S/C15H18N6S/c1-2-12-11-14(21-13(18-12)3-4-17-21)19-6-8-20(9-7-19)15-16-5-10-22-15/h3-5,10-11H,2,6-9H2,1H3
InChIKeyMOGRGNWJCVRCDX-UHFFFAOYSA-N
XLogP2.07
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.42
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole with MolForge

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Related Compounds

5-ethyl-7-(4-pyrazin-2-ylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
CID 56899455
(3R,4S)-4-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-1,4-diazepan-1-yl]oxolan-3-ol
CID 70745702
2-[4-(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]-1,3-thiazole
CID 133291472
ethane;2-pyrrolidin-1-yl-1,3-thiazole
CID 176952882
[2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 62752365
2-[4-(2-ethyl-6-methylpyrimidin-4-yl)piperazin-1-yl]-1,3-thiazole
CID 100758945
2-[4-(2-bromoethyl)piperazin-1-yl]-1,3-thiazole
CID 61288747
2-[4-[2-(bromomethyl)-5-chlorophenyl]piperazin-1-yl]-1,3-thiazole
CID 107079219
1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-2-ol
CID 60885531
[5-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]furan-2-yl]methanamine
CID 62423654
4-[(3S)-1-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-3-yl]-2-methyl-1H-pyrimidin-6-one
CID 136847948
1-butyl-4-(5-propylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-2-one
CID 56907344

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole?
The IUPAC name of 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole (CID 56909140) is 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole.
What is the SMILES notation for 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole?
The canonical SMILES for 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole is CCc1cc(N2CCN(c3nccs3)CC2)n2nccc2n1.
What is the InChIKey of 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole?
The InChIKey is MOGRGNWJCVRCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6S/c1-2-12-11-14(21-13(18-12)3-4-17-21)19-6-8-20(9-7-19)15-16-5-10-22-15/h3-5,10-11H,2,6-9H2,1H3.
What are the key properties of 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole?
2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole has a molecular weight of 314.42 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]-1,3-thiazole is sourced from PubChem (CID 56909140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).