2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C15H23N5 — CID 56917582

IUPAC2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NCCN2CCCC2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H23N5/c1-11-10-14(16-6-9-19-7-4-5-8-19)20-15(17-11)12(2)13(3)18-20/h10,16H,4-9H2,1-3H3
InChIKeyDMQFZWIVXUQSPX-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.16
Rot. Bonds4

About 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine

2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56917582) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56917582
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NCCN2CCCC2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H23N5/c1-11-10-14(16-6-9-19-7-4-5-8-19)20-15(17-11)12(2)13(3)18-20/h10,16H,4-9H2,1-3H3
InChIKeyDMQFZWIVXUQSPX-UHFFFAOYSA-N
XLogP2.16
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56917582) is 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(NCCN2CCCC2)n2nc(C)c(C)c2n1.
What is the InChIKey of 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is DMQFZWIVXUQSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-11-10-14(16-6-9-19-7-4-5-8-19)20-15(17-11)12(2)13(3)18-20/h10,16H,4-9H2,1-3H3.
What are the key properties of 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 273.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56917582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).