1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine

C16H25N5 — CID 70778203

IUPAC1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine
SMILESCCc1cc(N2CCC(N(C)C)C2)n2nc(C)c(C)c2n1
InChIInChI=1S/C16H25N5/c1-6-13-9-15(20-8-7-14(10-20)19(4)5)21-16(17-13)11(2)12(3)18-21/h9,14H,6-8,10H2,1-5H3
InChIKeyGRNTVJXOEZMMMJ-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.05
Rot. Bonds3

About 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine

1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine (PubChem CID 70778203) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine
PubChem CID70778203
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine
SMILESCCc1cc(N2CCC(N(C)C)C2)n2nc(C)c(C)c2n1
InChIInChI=1S/C16H25N5/c1-6-13-9-15(20-8-7-14(10-20)19(4)5)21-16(17-13)11(2)12(3)18-21/h9,14H,6-8,10H2,1-5H3
InChIKeyGRNTVJXOEZMMMJ-UHFFFAOYSA-N
XLogP2.05
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine (CID 70778203) is 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine is CCc1cc(N2CCC(N(C)C)C2)n2nc(C)c(C)c2n1.
What is the InChIKey of 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is GRNTVJXOEZMMMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-6-13-9-15(20-8-7-14(10-20)19(4)5)21-16(17-13)11(2)12(3)18-21/h9,14H,6-8,10H2,1-5H3.
What are the key properties of 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine?
1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 287.41 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 70778203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).