2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide

C7H5FN4O — CID 144642062

IUPAC2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c(F)nn2cccnc12
InChIInChI=1S/C7H5FN4O/c8-5-4(6(9)13)7-10-2-1-3-12(7)11-5/h1-3H,(H2,9,13)
InChIKeyWEVIAQZTSOPUDM-UHFFFAOYSA-N
MW180.14 g/mol
LogP-0.03
Rot. Bonds1

About 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide

2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 144642062) has the molecular formula C7H5FN4O and a molecular weight of 180.14 g/mol. Its IUPAC name is 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID144642062
Molecular FormulaC7H5FN4O
Molecular Weight180.14 g/mol
Exact Mass180.04
IUPAC Name2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c(F)nn2cccnc12
InChIInChI=1S/C7H5FN4O/c8-5-4(6(9)13)7-10-2-1-3-12(7)11-5/h1-3H,(H2,9,13)
InChIKeyWEVIAQZTSOPUDM-UHFFFAOYSA-N
XLogP-0.03
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.14
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 144642062) is 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1c(F)nn2cccnc12.
What is the InChIKey of 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is WEVIAQZTSOPUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN4O/c8-5-4(6(9)13)7-10-2-1-3-12(7)11-5/h1-3H,(H2,9,13).
What are the key properties of 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 180.14 g/mol, XLogP of -0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 144642062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).