2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide

C17H20N6O2 — CID 138992929

IUPAC2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
SMILESCc1nc2cc[nH]n2c(=O)c1CC(=O)NC1CCCc2nn(C)cc21
InChIInChI=1S/C17H20N6O2/c1-10-11(17(25)23-15(19-10)6-7-18-23)8-16(24)20-13-4-3-5-14-12(13)9-22(2)21-14/h6-7,9,13,18H,3-5,8H2,1-2H3,(H,20,24)
InChIKeyCUKWDOVMDOHUCF-UHFFFAOYSA-N
MW340.39 g/mol
LogP0.80
Rot. Bonds3

About 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide

2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide (PubChem CID 138992929) has the molecular formula C17H20N6O2 and a molecular weight of 340.39 g/mol. Its IUPAC name is 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
PubChem CID138992929
Molecular FormulaC17H20N6O2
Molecular Weight340.39 g/mol
Exact Mass340.16
IUPAC Name2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
SMILESCc1nc2cc[nH]n2c(=O)c1CC(=O)NC1CCCc2nn(C)cc21
InChIInChI=1S/C17H20N6O2/c1-10-11(17(25)23-15(19-10)6-7-18-23)8-16(24)20-13-4-3-5-14-12(13)9-22(2)21-14/h6-7,9,13,18H,3-5,8H2,1-2H3,(H,20,24)
InChIKeyCUKWDOVMDOHUCF-UHFFFAOYSA-N
XLogP0.80
TPSA97.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide?
The IUPAC name of 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide (CID 138992929) is 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide.
What is the SMILES notation for 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide?
The canonical SMILES for 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide is Cc1nc2cc[nH]n2c(=O)c1CC(=O)NC1CCCc2nn(C)cc21.
What is the InChIKey of 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide?
The InChIKey is CUKWDOVMDOHUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O2/c1-10-11(17(25)23-15(19-10)6-7-18-23)8-16(24)20-13-4-3-5-14-12(13)9-22(2)21-14/h6-7,9,13,18H,3-5,8H2,1-2H3,(H,20,24).
What are the key properties of 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide?
2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide has a molecular weight of 340.39 g/mol, XLogP of 0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide is sourced from PubChem (CID 138992929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).