1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone

C8H8N4O — CID 133063514

IUPAC1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone
SMILESCC(=O)c1cnn2c(N)ccnc12
InChIInChI=1S/C8H8N4O/c1-5(13)6-4-11-12-7(9)2-3-10-8(6)12/h2-4H,9H2,1H3
InChIKeyFWAGXUAWZZWQOO-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.51
Rot. Bonds1

About 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone

1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone (PubChem CID 133063514) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone.

Molecular Properties

Compound Name1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone
PubChem CID133063514
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone
SMILESCC(=O)c1cnn2c(N)ccnc12
InChIInChI=1S/C8H8N4O/c1-5(13)6-4-11-12-7(9)2-3-10-8(6)12/h2-4H,9H2,1H3
InChIKeyFWAGXUAWZZWQOO-UHFFFAOYSA-N
XLogP0.51
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone 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

7-amino-N-[1-hydroxy-3-(1,3-thiazol-5-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166334732
ethane;1-pyrazolo[1,5-a]pyrimidin-3-ylethanone
CID 91104664
2-[(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)amino]ethanol
CID 15553288
1-[7-amino-5-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl]ethanone
CID 164988100
N,N-dimethyl-7-[(3S)-1-propan-2-ylpyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124992229
cyclopentane;3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 143439835
ethyl 7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 4777079
1-(5-amino-1-propan-2-ylpyrazol-4-yl)ethanone
CID 119054332
ethyl 7-pyridin-4-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 12766264
3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 117103187
ethyl 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 11230936
7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 175662362

Frequently Asked Questions

What is the IUPAC name of 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone?
The IUPAC name of 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone (CID 133063514) is 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone.
What is the SMILES notation for 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone?
The canonical SMILES for 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone is CC(=O)c1cnn2c(N)ccnc12.
What is the InChIKey of 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone?
The InChIKey is FWAGXUAWZZWQOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c1-5(13)6-4-11-12-7(9)2-3-10-8(6)12/h2-4H,9H2,1H3.
What are the key properties of 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone?
1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone has a molecular weight of 176.18 g/mol, XLogP of 0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-aminopyrazolo[1,5-a]pyrimidin-3-yl)ethanone is sourced from PubChem (CID 133063514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).