5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C11H14N4O2 — CID 110485762

IUPAC5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(=O)n2[nH]cc(C(=O)NC(C)C)c2n1
InChIInChI=1S/C11H14N4O2/c1-6(2)13-11(17)8-5-12-15-9(16)4-7(3)14-10(8)15/h4-6,12H,1-3H3,(H,13,17)
InChIKeyMPUGKQVYJFRDAQ-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.47
Rot. Bonds2

About 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 110485762) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID110485762
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(=O)n2[nH]cc(C(=O)NC(C)C)c2n1
InChIInChI=1S/C11H14N4O2/c1-6(2)13-11(17)8-5-12-15-9(16)4-7(3)14-10(8)15/h4-6,12H,1-3H3,(H,13,17)
InChIKeyMPUGKQVYJFRDAQ-UHFFFAOYSA-N
XLogP0.47
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-5-methyl-N-(3-methylbutyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 3522948
N-(3-ethoxypropyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4134667
3,5-Dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 10820895
7-Hydroxy-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 110485760
N,2-dimethyl-7-oxo-N-(2,2,2-trifluoroethyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 145934845
3-[3-(fluoromethyl)pyrrolidine-1-carbonyl]-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 167746403
6-chloro-N-cyclopentyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 126479494
N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 16734509
5,6-dimethyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 20789834
N,2,6-trimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 23592542
N-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 58099986
2-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carbohydrazide
CID 58763167

Frequently Asked Questions

What is the IUPAC name of 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 110485762) is 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(=O)n2[nH]cc(C(=O)NC(C)C)c2n1.
What is the InChIKey of 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is MPUGKQVYJFRDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-6(2)13-11(17)8-5-12-15-9(16)4-7(3)14-10(8)15/h4-6,12H,1-3H3,(H,13,17).
What are the key properties of 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-7-oxo-N-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 110485762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).