6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

C13H17N3O3 — CID 82271719

IUPAC6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1nc2cc(C3CCCO3)[nH]n2c(=O)c1CCO
InChIInChI=1S/C13H17N3O3/c1-8-9(4-5-17)13(18)16-12(14-8)7-10(15-16)11-3-2-6-19-11/h7,11,15,17H,2-6H2,1H3
InChIKeyQUOJPETWAAWNNN-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.72
Rot. Bonds3

About 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 82271719) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID82271719
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1nc2cc(C3CCCO3)[nH]n2c(=O)c1CCO
InChIInChI=1S/C13H17N3O3/c1-8-9(4-5-17)13(18)16-12(14-8)7-10(15-16)11-3-2-6-19-11/h7,11,15,17H,2-6H2,1H3
InChIKeyQUOJPETWAAWNNN-UHFFFAOYSA-N
XLogP0.72
TPSA79.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2S)-1-(cyclopropanecarbonyl)pyrrolidin-2-yl]-5-methyl-6-(3-morpholin-4-yl-3-oxopropyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 124961630
3-[2-(1-acetylpyrrolidin-3-yl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-propan-2-ylpropanamide
CID 110091516
N-cyclopentyl-3-[2-[1-(cyclopropanecarbonyl)pyrrolidin-2-yl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propanamide
CID 110087985
2-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-5-methyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 124972680
3-[2-[(3R)-1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-propan-2-ylpropanamide
CID 124986576
5-methyl-6-(3-oxo-3-piperidin-1-ylpropyl)-2-(1-propan-2-ylpyrrolidin-3-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110259276
6-(2-bromoethyl)-5-methyl-2-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271797
2-amino-6-(2-hydroxyethyl)-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 64852966
2-tert-butyl-6-(2-chloroethyl)-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271773
5-methyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)-2-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 124965663
2-[1-(5,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)piperidin-2-yl]-6-ethyl-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110216136
2-[1-[2-(dimethylamino)pyrimidine-5-carbonyl]piperidin-3-yl]-6-ethyl-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110214681

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 82271719) is 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is Cc1nc2cc(C3CCCO3)[nH]n2c(=O)c1CCO.
What is the InChIKey of 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is QUOJPETWAAWNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-8-9(4-5-17)13(18)16-12(14-8)7-10(15-16)11-3-2-6-19-11/h7,11,15,17H,2-6H2,1H3.
What are the key properties of 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 263.30 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)-5-methyl-2-(oxolan-2-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 82271719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).