5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine

C19H26N6 — CID 56906237

IUPAC5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(N2CCC(CCn3ccnc3C)CC2)n2nccc2n1
InChIInChI=1S/C19H26N6/c1-3-17-14-19(25-18(22-17)4-8-21-25)24-11-6-16(7-12-24)5-10-23-13-9-20-15(23)2/h4,8-9,13-14,16H,3,5-7,10-12H2,1-2H3
InChIKeyQDKKZLCHOQFEGU-UHFFFAOYSA-N
MW338.46 g/mol
LogP3.10
Rot. Bonds5

About 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine

5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine (PubChem CID 56906237) has the molecular formula C19H26N6 and a molecular weight of 338.46 g/mol. Its IUPAC name is 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine
PubChem CID56906237
Molecular FormulaC19H26N6
Molecular Weight338.46 g/mol
Exact Mass338.22
IUPAC Name5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(N2CCC(CCn3ccnc3C)CC2)n2nccc2n1
InChIInChI=1S/C19H26N6/c1-3-17-14-19(25-18(22-17)4-8-21-25)24-11-6-16(7-12-24)5-10-23-13-9-20-15(23)2/h4,8-9,13-14,16H,3,5-7,10-12H2,1-2H3
InChIKeyQDKKZLCHOQFEGU-UHFFFAOYSA-N
XLogP3.10
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine with MolForge

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Related Compounds

Savolitinib
CID 68289010
Adipiplon
CID 11198924
1-cyclopentyl-3-(H-imidazo[1,2-a]pyridin-7-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 24905148
5,7-Dimethyl-2-(2-(6-(pyrrolidin-1-yl)pyrazin-2-yl)ethyl)-[1,2,4]triazolo-[1,5-a]pyrimidine
CID 72706927
2,3-dimethyl-5-(2-(1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)ethyl)pyrazolo[1,5-a]pyrimidine
CID 75201365
2,3,6-Trimethyl-5-(2-(1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)ethyl)pyrazolo[1,5-a]pyrimidine
CID 75201421
US10399985, Example 25
CID 118278077
US10399985, Example 23
CID 118278081
US10399985, Example 28
CID 118278095
US10399985, Example 16
CID 118278207
US10399985, Example 29
CID 118278224
US10399985, Example 27
CID 118278230

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine (CID 56906237) is 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine is CCc1cc(N2CCC(CCn3ccnc3C)CC2)n2nccc2n1.
What is the InChIKey of 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is QDKKZLCHOQFEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6/c1-3-17-14-19(25-18(22-17)4-8-21-25)24-11-6-16(7-12-24)5-10-23-13-9-20-15(23)2/h4,8-9,13-14,16H,3,5-7,10-12H2,1-2H3.
What are the key properties of 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 338.46 g/mol, XLogP of 3.10, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-7-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 56906237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).