5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

C14H17N5S — CID 70711262

IUPAC5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCCc2nc(C)cs2)n2nccc2n1
InChIInChI=1S/C14H17N5S/c1-3-11-8-13(19-12(18-11)4-7-16-19)15-6-5-14-17-10(2)9-20-14/h4,7-9,15H,3,5-6H2,1-2H3
InChIKeyRQLPGRFJGGNBOH-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.71
Rot. Bonds5

About 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70711262) has the molecular formula C14H17N5S and a molecular weight of 287.39 g/mol. Its IUPAC name is 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70711262
Molecular FormulaC14H17N5S
Molecular Weight287.39 g/mol
Exact Mass287.12
IUPAC Name5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCCc2nc(C)cs2)n2nccc2n1
InChIInChI=1S/C14H17N5S/c1-3-11-8-13(19-12(18-11)4-7-16-19)15-6-5-14-17-10(2)9-20-14/h4,7-9,15H,3,5-6H2,1-2H3
InChIKeyRQLPGRFJGGNBOH-UHFFFAOYSA-N
XLogP2.71
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 70711262) is 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(NCCc2nc(C)cs2)n2nccc2n1.
What is the InChIKey of 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is RQLPGRFJGGNBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5S/c1-3-11-8-13(19-12(18-11)4-7-16-19)15-6-5-14-17-10(2)9-20-14/h4,7-9,15H,3,5-6H2,1-2H3.
What are the key properties of 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 287.39 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70711262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).