2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol

C12H17N5O — CID 167821980

IUPAC2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol
SMILESOCCN1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C12H17N5O/c18-10-9-15-5-7-16(8-6-15)12-2-3-13-11-1-4-14-17(11)12/h1-4,18H,5-10H2
InChIKeyAQOFIDLKQHTOEJ-UHFFFAOYSA-N
MW247.30 g/mol
LogP-0.16
Rot. Bonds3

About 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol

2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol (PubChem CID 167821980) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol
PubChem CID167821980
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol
SMILESOCCN1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C12H17N5O/c18-10-9-15-5-7-16(8-6-15)12-2-3-13-11-1-4-14-17(11)12/h1-4,18H,5-10H2
InChIKeyAQOFIDLKQHTOEJ-UHFFFAOYSA-N
XLogP-0.16
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-[4-(benzenesulfonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
CID 110874095
2-[4-(4-bromo-2-pyridinyl)-1,4-diazepan-1-yl]ethanol
CID 118140352
CID 134796696
CID 134796696
2-[4-[2-(trifluoromethyl)-4-pyridinyl]piperazin-1-yl]ethanol
CID 171701811
2-[4-(2-ethynylpyrimidin-4-yl)piperazin-1-yl]ethanol
CID 18452544
4-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-2-carbonitrile
CID 62491107
4-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]pyridine-2-carbonitrile
CID 55205409
2-[4-(2-hydrazinylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanol
CID 107226843
2-(4-pyrazin-2-yl-1,4-diazepan-1-yl)ethanol
CID 63309595
1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]isoquinolin-7-ol
CID 106541481
2-[4-(4-nitro-2-pyridinyl)-1,4-diazepan-1-yl]ethanol
CID 63309676
2-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-4-methylpyridine-3-carbothioamide
CID 107223114

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol?
The IUPAC name of 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol (CID 167821980) is 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol.
What is the SMILES notation for 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol?
The canonical SMILES for 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol is OCCN1CCN(c2ccnc3ccnn23)CC1.
What is the InChIKey of 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol?
The InChIKey is AQOFIDLKQHTOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c18-10-9-15-5-7-16(8-6-15)12-2-3-13-11-1-4-14-17(11)12/h1-4,18H,5-10H2.
What are the key properties of 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol?
2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol has a molecular weight of 247.30 g/mol, XLogP of -0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperazin-1-yl)ethanol is sourced from PubChem (CID 167821980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).