5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine

C16H23N5O — CID 82270552

IUPAC5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(N2CCNCC2)n2nc(C3CCCO3)cc2n1
InChIInChI=1S/C16H23N5O/c1-2-12-10-16(20-7-5-17-6-8-20)21-15(18-12)11-13(19-21)14-4-3-9-22-14/h10-11,14,17H,2-9H2,1H3
InChIKeyBPODVWXVIZEPNA-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.55
Rot. Bonds3

About 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine

5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 82270552) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
PubChem CID82270552
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(N2CCNCC2)n2nc(C3CCCO3)cc2n1
InChIInChI=1S/C16H23N5O/c1-2-12-10-16(20-7-5-17-6-8-20)21-15(18-12)11-13(19-21)14-4-3-9-22-14/h10-11,14,17H,2-9H2,1H3
InChIKeyBPODVWXVIZEPNA-UHFFFAOYSA-N
XLogP1.55
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-ethyl-5-phenyl-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
CID 82270574
[2-(oxolan-2-yl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]hydrazine
CID 82270442
(2-cyclobutyl-5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)hydrazine
CID 82270323
5-methyl-2-phenyl-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
CID 82270537
5-methyl-7-(4-methylpiperazin-1-yl)-2-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine
CID 138391870
(3R)-3-methyl-1-[5-(oxolan-2-yl)-1H-1,2,4-triazol-3-yl]piperazine
CID 102797516
4-chloro-2-(chloromethyl)-6-(oxolan-2-yl)pyrimidine
CID 102538380
N'-[5-ethyl-2-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
CID 82270640
1-(1-cyclopentyl-4-ethylimidazol-2-yl)piperazine
CID 106552037
7-[(3R)-3-phenylpiperazin-1-yl]-5-propylpyrazolo[1,5-a]pyrimidine
CID 95708915
5-ethyl-7-(4-pyrazin-2-ylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
CID 56899455
2-(oxolan-2-yl)-4-piperazin-1-yl-1,3-benzoxazole
CID 82346417

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine (CID 82270552) is 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine is CCc1cc(N2CCNCC2)n2nc(C3CCCO3)cc2n1.
What is the InChIKey of 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is BPODVWXVIZEPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-2-12-10-16(20-7-5-17-6-8-20)21-15(18-12)11-13(19-21)14-4-3-9-22-14/h10-11,14,17H,2-9H2,1H3.
What are the key properties of 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 301.39 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(oxolan-2-yl)-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 82270552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).