N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

C14H10F2N4O — CID 84575701

IUPACN-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc2nccc(C(=O)Nc3cc(F)ccc3F)n2n1
InChIInChI=1S/C14H10F2N4O/c1-8-6-13-17-5-4-12(20(13)19-8)14(21)18-11-7-9(15)2-3-10(11)16/h2-7H,1H3,(H,18,21)
InChIKeyGRAKIJXSBHSAJI-UHFFFAOYSA-N
MW288.26 g/mol
LogP2.57
Rot. Bonds2

About N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 84575701) has the molecular formula C14H10F2N4O and a molecular weight of 288.26 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID84575701
Molecular FormulaC14H10F2N4O
Molecular Weight288.26 g/mol
Exact Mass288.08
IUPAC NameN-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc2nccc(C(=O)Nc3cc(F)ccc3F)n2n1
InChIInChI=1S/C14H10F2N4O/c1-8-6-13-17-5-4-12(20(13)19-8)14(21)18-11-7-9(15)2-3-10(11)16/h2-7H,1H3,(H,18,21)
InChIKeyGRAKIJXSBHSAJI-UHFFFAOYSA-N
XLogP2.57
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethylphenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84575460
N-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84580925
N-(2,5-difluorophenyl)-7-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 5243772
N-(2,5-difluorophenyl)-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 4863093
N-(2,4-difluorophenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 110685919
N-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 110858618
2-methyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84576023
N-(2,5-difluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 1169206
N-[2-(4-methoxyphenoxy)ethyl]-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84575522
4-amino-N-(2,5-difluorophenyl)-1,3-dimethylpyrazole-5-carboxamide
CID 66121252
2-(aminomethyl)-N-(2,5-difluorophenyl)pyridine-4-carboxamide
CID 114325502
2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84575518

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (CID 84575701) is N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is Cc1cc2nccc(C(=O)Nc3cc(F)ccc3F)n2n1.
What is the InChIKey of N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is GRAKIJXSBHSAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N4O/c1-8-6-13-17-5-4-12(20(13)19-8)14(21)18-11-7-9(15)2-3-10(11)16/h2-7H,1H3,(H,18,21).
What are the key properties of N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 288.26 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 84575701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).