7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C22H19FN4O — CID 46079633

IUPAC7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCCNC(=O)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C22H19FN4O/c1-2-12-24-22(28)19-13-20(16-10-6-7-11-17(16)23)27-21(25-19)14-18(26-27)15-8-4-3-5-9-15/h3-11,13-14H,2,12H2,1H3,(H,24,28)
InChIKeyAOMMGOXHYIXOGV-UHFFFAOYSA-N
MW374.42 g/mol
LogP4.34
Rot. Bonds5

About 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide

7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 46079633) has the molecular formula C22H19FN4O and a molecular weight of 374.42 g/mol. Its IUPAC name is 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID46079633
Molecular FormulaC22H19FN4O
Molecular Weight374.42 g/mol
Exact Mass374.15
IUPAC Name7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCCNC(=O)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C22H19FN4O/c1-2-12-24-22(28)19-13-20(16-10-6-7-11-17(16)23)27-21(25-19)14-18(26-27)15-8-4-3-5-9-15/h3-11,13-14H,2,12H2,1H3,(H,24,28)
InChIKeyAOMMGOXHYIXOGV-UHFFFAOYSA-N
XLogP4.34
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-(2-fluorophenyl)-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 42877285
7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 42877286
N-[2-(dimethylamino)ethyl]-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 24716905
7-methyl-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 5149768
7-methyl-2-phenyl-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 46170354
ethyl 7-(3,4-difluorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylate
CID 164946423
2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-methoxyethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 42877638
5-(2-fluorophenyl)-N-(furan-2-ylmethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 46080130
5-(2-fluorophenyl)-N-(1-methylazetidin-3-yl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 170090156
5-(2-fluorophenyl)-2-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 46080172
2-(4-chlorophenyl)-N,N-diethyl-5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 42877611
5-(4-fluorophenyl)-N-propyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3122949

Frequently Asked Questions

What is the IUPAC name of 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 46079633) is 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide is CCCNC(=O)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1.
What is the InChIKey of 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is AOMMGOXHYIXOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O/c1-2-12-24-22(28)19-13-20(16-10-6-7-11-17(16)23)27-21(25-19)14-18(26-27)15-8-4-3-5-9-15/h3-11,13-14H,2,12H2,1H3,(H,24,28).
What are the key properties of 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 374.42 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 46079633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).