N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine

C15H20N6 — CID 70708405

IUPACN-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NCC(C)n2ccnc2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H20N6/c1-10-7-14(17-8-11(2)20-6-5-16-9-20)21-15(18-10)12(3)13(4)19-21/h5-7,9,11,17H,8H2,1-4H3
InChIKeyLXXRBSVTWBJIMS-UHFFFAOYSA-N
MW284.37 g/mol
LogP2.52
Rot. Bonds4

About N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine

N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70708405) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70708405
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NCC(C)n2ccnc2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H20N6/c1-10-7-14(17-8-11(2)20-6-5-16-9-20)21-15(18-10)12(3)13(4)19-21/h5-7,9,11,17H,8H2,1-4H3
InChIKeyLXXRBSVTWBJIMS-UHFFFAOYSA-N
XLogP2.52
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine (CID 70708405) is N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(NCC(C)n2ccnc2)n2nc(C)c(C)c2n1.
What is the InChIKey of N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is LXXRBSVTWBJIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-10-7-14(17-8-11(2)20-6-5-16-9-20)21-15(18-10)12(3)13(4)19-21/h5-7,9,11,17H,8H2,1-4H3.
What are the key properties of N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine?
N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 284.37 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylpropyl)-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70708405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).