5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide

C7H6N4O2 — CID 138489583

IUPAC5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide
SMILESNC(=O)c1cnc2[nH]ccn2c1=O
InChIInChI=1S/C7H6N4O2/c8-5(12)4-3-10-7-9-1-2-11(7)6(4)13/h1-3H,(H2,8,12)(H,9,10)
InChIKeyVDVMPJPIVPXOPD-UHFFFAOYSA-N
MW178.15 g/mol
LogP-0.88
Rot. Bonds1

About 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide

5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide (PubChem CID 138489583) has the molecular formula C7H6N4O2 and a molecular weight of 178.15 g/mol. Its IUPAC name is 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide
PubChem CID138489583
Molecular FormulaC7H6N4O2
Molecular Weight178.15 g/mol
Exact Mass178.05
IUPAC Name5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide
SMILESNC(=O)c1cnc2[nH]ccn2c1=O
InChIInChI=1S/C7H6N4O2/c8-5(12)4-3-10-7-9-1-2-11(7)6(4)13/h1-3H,(H2,8,12)(H,9,10)
InChIKeyVDVMPJPIVPXOPD-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 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide (CID 138489583) is 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide is NC(=O)c1cnc2[nH]ccn2c1=O.
What is the InChIKey of 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide?
The InChIKey is VDVMPJPIVPXOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O2/c8-5(12)4-3-10-7-9-1-2-11(7)6(4)13/h1-3H,(H2,8,12)(H,9,10).
What are the key properties of 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide?
5-oxo-1H-imidazo[1,2-a]pyrimidine-6-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 5-oxo-1H-imidazo[1,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 138489583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).