5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C14H16N4S — CID 56896692

IUPAC5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC(C)Cc2cccs2)n2nccc2n1
InChIInChI=1S/C14H16N4S/c1-10(8-12-4-3-7-19-12)17-14-9-11(2)16-13-5-6-15-18(13)14/h3-7,9-10,17H,8H2,1-2H3
InChIKeyCYOKIENASYCMOH-UHFFFAOYSA-N
MW272.38 g/mol
LogP3.14
Rot. Bonds4

About 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56896692) has the molecular formula C14H16N4S and a molecular weight of 272.38 g/mol. Its IUPAC name is 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56896692
Molecular FormulaC14H16N4S
Molecular Weight272.38 g/mol
Exact Mass272.11
IUPAC Name5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC(C)Cc2cccs2)n2nccc2n1
InChIInChI=1S/C14H16N4S/c1-10(8-12-4-3-7-19-12)17-14-9-11(2)16-13-5-6-15-18(13)14/h3-7,9-10,17H,8H2,1-2H3
InChIKeyCYOKIENASYCMOH-UHFFFAOYSA-N
XLogP3.14
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56896692) is 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(NC(C)Cc2cccs2)n2nccc2n1.
What is the InChIKey of 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is CYOKIENASYCMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4S/c1-10(8-12-4-3-7-19-12)17-14-9-11(2)16-13-5-6-15-18(13)14/h3-7,9-10,17H,8H2,1-2H3.
What are the key properties of 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 272.38 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56896692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).