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

C7H6FN5O — CID 142772738

IUPAC2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c(N)nn2cc(F)cnc12
InChIInChI=1S/C7H6FN5O/c8-3-1-11-7-4(6(10)14)5(9)12-13(7)2-3/h1-2H,(H2,9,12)(H2,10,14)
InChIKeyJMNWZNBVVUPJPY-UHFFFAOYSA-N
MW195.16 g/mol
LogP-0.45
Rot. Bonds1

About 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 142772738) has the molecular formula C7H6FN5O and a molecular weight of 195.16 g/mol. Its IUPAC name is 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID142772738
Molecular FormulaC7H6FN5O
Molecular Weight195.16 g/mol
Exact Mass195.06
IUPAC Name2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c(N)nn2cc(F)cnc12
InChIInChI=1S/C7H6FN5O/c8-3-1-11-7-4(6(10)14)5(9)12-13(7)2-3/h1-2H,(H2,9,12)(H2,10,14)
InChIKeyJMNWZNBVVUPJPY-UHFFFAOYSA-N
XLogP-0.45
TPSA99.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.16
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 142772738) is 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1c(N)nn2cc(F)cnc12.
What is the InChIKey of 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is JMNWZNBVVUPJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6FN5O/c8-3-1-11-7-4(6(10)14)5(9)12-13(7)2-3/h1-2H,(H2,9,12)(H2,10,14).
What are the key properties of 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 195.16 g/mol, XLogP of -0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 142772738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).