3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine

C19H19FN4 — CID 156641448

IUPAC3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1-c1nn2ccc(N3CCCC3)nc2c1C1CC1
InChIInChI=1S/C19H19FN4/c20-15-6-2-1-5-14(15)18-17(13-7-8-13)19-21-16(9-12-24(19)22-18)23-10-3-4-11-23/h1-2,5-6,9,12-13H,3-4,7-8,10-11H2
InChIKeySSZFBPADYWNBHM-UHFFFAOYSA-N
MW322.39 g/mol
LogP4.01
Rot. Bonds3

About 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine

3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 156641448) has the molecular formula C19H19FN4 and a molecular weight of 322.39 g/mol. Its IUPAC name is 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
PubChem CID156641448
Molecular FormulaC19H19FN4
Molecular Weight322.39 g/mol
Exact Mass322.16
IUPAC Name3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1-c1nn2ccc(N3CCCC3)nc2c1C1CC1
InChIInChI=1S/C19H19FN4/c20-15-6-2-1-5-14(15)18-17(13-7-8-13)19-21-16(9-12-24(19)22-18)23-10-3-4-11-23/h1-2,5-6,9,12-13H,3-4,7-8,10-11H2
InChIKeySSZFBPADYWNBHM-UHFFFAOYSA-N
XLogP4.01
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine (CID 156641448) is 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine is Fc1ccccc1-c1nn2ccc(N3CCCC3)nc2c1C1CC1.
What is the InChIKey of 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is SSZFBPADYWNBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4/c20-15-6-2-1-5-14(15)18-17(13-7-8-13)19-21-16(9-12-24(19)22-18)23-10-3-4-11-23/h1-2,5-6,9,12-13H,3-4,7-8,10-11H2.
What are the key properties of 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 322.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 156641448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).