N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C13H10N6O2 — CID 122515270

IUPACN-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnccc1NC(=O)c1cnn2cccnc12
InChIInChI=1S/C13H10N6O2/c14-11(20)8-6-15-4-2-10(8)18-13(21)9-7-17-19-5-1-3-16-12(9)19/h1-7H,(H2,14,20)(H,15,18,21)
InChIKeyKJKUNHHJISIVLH-UHFFFAOYSA-N
MW282.26 g/mol
LogP0.48
Rot. Bonds3

About N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 122515270) has the molecular formula C13H10N6O2 and a molecular weight of 282.26 g/mol. Its IUPAC name is N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID122515270
Molecular FormulaC13H10N6O2
Molecular Weight282.26 g/mol
Exact Mass282.09
IUPAC NameN-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnccc1NC(=O)c1cnn2cccnc12
InChIInChI=1S/C13H10N6O2/c14-11(20)8-6-15-4-2-10(8)18-13(21)9-7-17-19-5-1-3-16-12(9)19/h1-7H,(H2,14,20)(H,15,18,21)
InChIKeyKJKUNHHJISIVLH-UHFFFAOYSA-N
XLogP0.48
TPSA115.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 122515270) is N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnccc1NC(=O)c1cnn2cccnc12.
What is the InChIKey of N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is KJKUNHHJISIVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6O2/c14-11(20)8-6-15-4-2-10(8)18-13(21)9-7-17-19-5-1-3-16-12(9)19/h1-7H,(H2,14,20)(H,15,18,21).
What are the key properties of N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 282.26 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoyl-4-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 122515270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).