7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C13H10N4O — CID 14501860

IUPAC7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(-c3ccccc3)ccnc12
InChIInChI=1S/C13H10N4O/c14-12(18)10-8-16-17-11(6-7-15-13(10)17)9-4-2-1-3-5-9/h1-8H,(H2,14,18)
InChIKeyNIEIVFHQPZKLEN-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.50
Rot. Bonds2

About 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 14501860) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID14501860
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC Name7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(-c3ccccc3)ccnc12
InChIInChI=1S/C13H10N4O/c14-12(18)10-8-16-17-11(6-7-15-13(10)17)9-4-2-1-3-5-9/h1-8H,(H2,14,18)
InChIKeyNIEIVFHQPZKLEN-UHFFFAOYSA-N
XLogP1.50
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 14501860) is 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2c(-c3ccccc3)ccnc12.
What is the InChIKey of 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is NIEIVFHQPZKLEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c14-12(18)10-8-16-17-11(6-7-15-13(10)17)9-4-2-1-3-5-9/h1-8H,(H2,14,18).
What are the key properties of 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 14501860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).