3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

C8H8N4O2 — CID 163398085

IUPAC3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESNC(=O)C1CC(c2cnccn2)=NO1
InChIInChI=1S/C8H8N4O2/c9-8(13)7-3-5(12-14-7)6-4-10-1-2-11-6/h1-2,4,7H,3H2,(H2,9,13)
InChIKeyPRWVTCJYHRZTFP-UHFFFAOYSA-N
MW192.18 g/mol
LogP-0.55
Rot. Bonds2

About 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide (PubChem CID 163398085) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
PubChem CID163398085
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESNC(=O)C1CC(c2cnccn2)=NO1
InChIInChI=1S/C8H8N4O2/c9-8(13)7-3-5(12-14-7)6-4-10-1-2-11-6/h1-2,4,7H,3H2,(H2,9,13)
InChIKeyPRWVTCJYHRZTFP-UHFFFAOYSA-N
XLogP-0.55
TPSA90.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide (CID 163398085) is 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide is NC(=O)C1CC(c2cnccn2)=NO1.
What is the InChIKey of 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The InChIKey is PRWVTCJYHRZTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c9-8(13)7-3-5(12-14-7)6-4-10-1-2-11-6/h1-2,4,7H,3H2,(H2,9,13).
What are the key properties of 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide has a molecular weight of 192.18 g/mol, XLogP of -0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazin-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 163398085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).