3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine

C16H10FN3S — CID 1472857

IUPAC3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
SMILESFc1ccc(-c2cnn3c(-c4cccs4)ccnc23)cc1
InChIInChI=1S/C16H10FN3S/c17-12-5-3-11(4-6-12)13-10-19-20-14(7-8-18-16(13)20)15-2-1-9-21-15/h1-10H
InChIKeyHCCADCGJTAFYPW-UHFFFAOYSA-N
MW295.34 g/mol
LogP4.26
Rot. Bonds2

About 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine

3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 1472857) has the molecular formula C16H10FN3S and a molecular weight of 295.34 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID1472857
Molecular FormulaC16H10FN3S
Molecular Weight295.34 g/mol
Exact Mass295.06
IUPAC Name3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
SMILESFc1ccc(-c2cnn3c(-c4cccs4)ccnc23)cc1
InChIInChI=1S/C16H10FN3S/c17-12-5-3-11(4-6-12)13-10-19-20-14(7-8-18-16(13)20)15-2-1-9-21-15/h1-10H
InChIKeyHCCADCGJTAFYPW-UHFFFAOYSA-N
XLogP4.26
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Dimethyl-6-(2-thienyl)-4-(trifluoromethyl)-1H-pyrazolo(3,4-B)pyridine
CID 2164249
Lorediplon
CID 12004146
6-[(4-Fluorophenyl)methylsulfanyl]-3-pyridin-3-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 7190719
2-{3-Phenylpyrazolo[1,5-a]pyrimidin-6-yl}pyridine
CID 5329461
Pyrazolo[1,5-a]pyrimidine, 3-(4-fluorophenyl)-6-(4-pyridinyl)-
CID 5329462
4-[3-(Thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329467
6-Cyclohexyl-3-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidine
CID 5329472
7-(Thiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 900945
Adenosine receptor antagonist 3
CID 146268692
2-Pyrazolo[1,5-a]pyrimidin-3-yl-1,3-benzothiazole
CID 156010635
5-(3-Cyclopropylsulfonylphenyl)-3-(4-methylsulfonylphenyl)pyrazolo[1,5-a]pyrimidine
CID 122193263
4-(5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 137661231

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine (CID 1472857) is 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine is Fc1ccc(-c2cnn3c(-c4cccs4)ccnc23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is HCCADCGJTAFYPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3S/c17-12-5-3-11(4-6-12)13-10-19-20-14(7-8-18-16(13)20)15-2-1-9-21-15/h1-10H.
What are the key properties of 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 295.34 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 1472857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).