5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

C16H25N5 — CID 56901411

IUPAC5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)c1cc(NCC(C)N2CCCC2)n2nccc2n1
InChIInChI=1S/C16H25N5/c1-12(2)14-10-16(21-15(19-14)6-7-18-21)17-11-13(3)20-8-4-5-9-20/h6-7,10,12-13,17H,4-5,8-9,11H2,1-3H3
InChIKeyRZVYLFQMNDDSJV-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.75
Rot. Bonds5

About 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56901411) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56901411
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)c1cc(NCC(C)N2CCCC2)n2nccc2n1
InChIInChI=1S/C16H25N5/c1-12(2)14-10-16(21-15(19-14)6-7-18-21)17-11-13(3)20-8-4-5-9-20/h6-7,10,12-13,17H,4-5,8-9,11H2,1-3H3
InChIKeyRZVYLFQMNDDSJV-UHFFFAOYSA-N
XLogP2.75
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56901411) is 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is CC(C)c1cc(NCC(C)N2CCCC2)n2nccc2n1.
What is the InChIKey of 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is RZVYLFQMNDDSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-12(2)14-10-16(21-15(19-14)6-7-18-21)17-11-13(3)20-8-4-5-9-20/h6-7,10,12-13,17H,4-5,8-9,11H2,1-3H3.
What are the key properties of 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 287.41 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-N-(2-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56901411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).