5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C16H20N6 — CID 70762143

IUPAC5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(N(C)Cc2ccncn2)n2nc(C)c(C)c2n1
InChIInChI=1S/C16H20N6/c1-5-13-8-15(21(4)9-14-6-7-17-10-18-14)22-16(19-13)11(2)12(3)20-22/h6-8,10H,5,9H2,1-4H3
InChIKeyRCCDSTCIQPQWDB-UHFFFAOYSA-N
MW296.38 g/mol
LogP2.33
Rot. Bonds4

About 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70762143) has the molecular formula C16H20N6 and a molecular weight of 296.38 g/mol. Its IUPAC name is 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70762143
Molecular FormulaC16H20N6
Molecular Weight296.38 g/mol
Exact Mass296.17
IUPAC Name5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(N(C)Cc2ccncn2)n2nc(C)c(C)c2n1
InChIInChI=1S/C16H20N6/c1-5-13-8-15(21(4)9-14-6-7-17-10-18-14)22-16(19-13)11(2)12(3)20-22/h6-8,10H,5,9H2,1-4H3
InChIKeyRCCDSTCIQPQWDB-UHFFFAOYSA-N
XLogP2.33
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.38
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 70762143) is 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(N(C)Cc2ccncn2)n2nc(C)c(C)c2n1.
What is the InChIKey of 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is RCCDSTCIQPQWDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6/c1-5-13-8-15(21(4)9-14-6-7-17-10-18-14)22-16(19-13)11(2)12(3)20-22/h6-8,10H,5,9H2,1-4H3.
What are the key properties of 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 296.38 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,2,3-trimethyl-N-(pyrimidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70762143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).