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

C7H5FN4O — CID 90205392

IUPAC6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2cc(F)cnc12
InChIInChI=1S/C7H5FN4O/c8-4-1-10-7-5(6(9)13)2-11-12(7)3-4/h1-3H,(H2,9,13)
InChIKeySYRFQJXUEIFNLY-UHFFFAOYSA-N
MW180.14 g/mol
LogP-0.03
Rot. Bonds1

About 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide

6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 90205392) has the molecular formula C7H5FN4O and a molecular weight of 180.14 g/mol. Its IUPAC name is 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID90205392
Molecular FormulaC7H5FN4O
Molecular Weight180.14 g/mol
Exact Mass180.04
IUPAC Name6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2cc(F)cnc12
InChIInChI=1S/C7H5FN4O/c8-4-1-10-7-5(6(9)13)2-11-12(7)3-4/h1-3H,(H2,9,13)
InChIKeySYRFQJXUEIFNLY-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 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 90205392) is 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2cc(F)cnc12.
What is the InChIKey of 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is SYRFQJXUEIFNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN4O/c8-4-1-10-7-5(6(9)13)2-11-12(7)3-4/h1-3H,(H2,9,13).
What are the key properties of 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-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 6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 90205392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).