N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C16H14N4O2 — CID 110861224

IUPACN-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(C)n3nccc3n2)cc1
InChIInChI=1S/C16H14N4O2/c1-10-9-14(19-15-7-8-17-20(10)15)16(22)18-13-5-3-12(4-6-13)11(2)21/h3-9H,1-2H3,(H,18,22)
InChIKeyUOGOTOQTSWSBRV-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.49
Rot. Bonds3

About N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 110861224) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID110861224
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC NameN-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(C)n3nccc3n2)cc1
InChIInChI=1S/C16H14N4O2/c1-10-9-14(19-15-7-8-17-20(10)15)16(22)18-13-5-3-12(4-6-13)11(2)21/h3-9H,1-2H3,(H,18,22)
InChIKeyUOGOTOQTSWSBRV-UHFFFAOYSA-N
XLogP2.49
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53179890
N-phenyl-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040898
N-(4-acetylphenyl)-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3991557
N-cycloheptyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110855510
7-ethyl-N-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040834
1-[4-(7-methylpyrazolo[1,5-a]pyrimidine-5-carbonyl)piperazin-1-yl]ethanone
CID 110850426
N-(4-acetylphenyl)-6-(4-methoxyanilino)-2-methylpyrimidine-4-carboxamide
CID 112850552
N-(4-acetylphenyl)pyrazine-2-carboxamide
CID 803592
4-(4-acetylanilino)-N-(4-acetylphenyl)pyridine-2-carboxamide
CID 109222150
N-(4-acetylphenyl)-4-aminopyridine-2-carboxamide
CID 82299178
N-(4-acetylphenyl)-6-(4-cyanoanilino)-2-methylpyrimidine-4-carboxamide
CID 112850845
N-(4-acetylphenyl)-2-(butan-2-ylamino)-6-methylpyrimidine-4-carboxamide
CID 109321317

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 110861224) is N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is CC(=O)c1ccc(NC(=O)c2cc(C)n3nccc3n2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is UOGOTOQTSWSBRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-10-9-14(19-15-7-8-17-20(10)15)16(22)18-13-5-3-12(4-6-13)11(2)21/h3-9H,1-2H3,(H,18,22).
What are the key properties of N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 110861224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).