6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H16N6O — CID 162637073

IUPAC6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)Nc3n[nH]c(-c4ccccc4)c3C)cnn2c1
InChIInChI=1S/C18H16N6O/c1-11-8-19-17-14(9-20-24(17)10-11)18(25)21-16-12(2)15(22-23-16)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2,21,22,23,25)
InChIKeyBZJFLNOXZDEFJB-UHFFFAOYSA-N
MW332.37 g/mol
LogP2.99
Rot. Bonds3

About 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 162637073) has the molecular formula C18H16N6O and a molecular weight of 332.37 g/mol. Its IUPAC name is 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID162637073
Molecular FormulaC18H16N6O
Molecular Weight332.37 g/mol
Exact Mass332.14
IUPAC Name6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)Nc3n[nH]c(-c4ccccc4)c3C)cnn2c1
InChIInChI=1S/C18H16N6O/c1-11-8-19-17-14(9-20-24(17)10-11)18(25)21-16-12(2)15(22-23-16)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2,21,22,23,25)
InChIKeyBZJFLNOXZDEFJB-UHFFFAOYSA-N
XLogP2.99
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.37
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 134708782
N-[5-(difluoromethyl)-1H-pyrazol-4-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 156823516
N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)-4-phenylpyrimidine-2-carboxamide
CID 166432284
methyl 6-methylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 129298169
6-methyl-N-[3-(pyridine-3-carbonylamino)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 131923435
N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)-1H-indole-2-carboxamide
CID 166403574
amino-(4-methyl-5-phenyl-1H-pyrazol-3-yl)carbamic acid
CID 175320045
N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 59509139
3-cyano-5-fluoro-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)benzamide
CID 156583771
N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58056308
N-[4-methyl-5-(4-methylphenyl)-1H-pyrazol-3-yl]-3-sulfanylbenzamide
CID 70826272
N-[[2-(diethylamino)-3-pyridinyl]methyl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56748172

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 162637073) is 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)Nc3n[nH]c(-c4ccccc4)c3C)cnn2c1.
What is the InChIKey of 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is BZJFLNOXZDEFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O/c1-11-8-19-17-14(9-20-24(17)10-11)18(25)21-16-12(2)15(22-23-16)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2,21,22,23,25).
What are the key properties of 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 332.37 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-methyl-5-phenyl-1H-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 162637073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).