7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C7H6N4O2 — CID 130615800

IUPAC7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c[nH]n2c(=O)ccnc12
InChIInChI=1S/C7H6N4O2/c8-6(13)4-3-10-11-5(12)1-2-9-7(4)11/h1-3,10H,(H2,8,13)
InChIKeyVBGZBOVVPHRZBP-UHFFFAOYSA-N
MW178.15 g/mol
LogP-0.88
Rot. Bonds1

About 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 130615800) has the molecular formula C7H6N4O2 and a molecular weight of 178.15 g/mol. Its IUPAC name is 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID130615800
Molecular FormulaC7H6N4O2
Molecular Weight178.15 g/mol
Exact Mass178.05
IUPAC Name7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1c[nH]n2c(=O)ccnc12
InChIInChI=1S/C7H6N4O2/c8-6(13)4-3-10-11-5(12)1-2-9-7(4)11/h1-3,10H,(H2,8,13)
InChIKeyVBGZBOVVPHRZBP-UHFFFAOYSA-N
XLogP-0.88
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.15
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 130615800) is 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1c[nH]n2c(=O)ccnc12.
What is the InChIKey of 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VBGZBOVVPHRZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O2/c8-6(13)4-3-10-11-5(12)1-2-9-7(4)11/h1-3,10H,(H2,8,13).
What are the key properties of 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 178.15 g/mol, XLogP of -0.88, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 130615800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).