5-propyl-1,2-oxazole-4-carboxamide

C7H10N2O2 — CID 67871556

IUPAC5-propyl-1,2-oxazole-4-carboxamide
SMILESCCCc1oncc1C(N)=O
InChIInChI=1S/C7H10N2O2/c1-2-3-6-5(7(8)10)4-9-11-6/h4H,2-3H2,1H3,(H2,8,10)
InChIKeyJXBFFIMLJQFWBA-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.73
Rot. Bonds3

About 5-propyl-1,2-oxazole-4-carboxamide

5-propyl-1,2-oxazole-4-carboxamide (PubChem CID 67871556) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-propyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-propyl-1,2-oxazole-4-carboxamide
PubChem CID67871556
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name5-propyl-1,2-oxazole-4-carboxamide
SMILESCCCc1oncc1C(N)=O
InChIInChI=1S/C7H10N2O2/c1-2-3-6-5(7(8)10)4-9-11-6/h4H,2-3H2,1H3,(H2,8,10)
InChIKeyJXBFFIMLJQFWBA-UHFFFAOYSA-N
XLogP0.73
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-propyl-1,2-oxazole-4-carboxamide (CID 67871556) is 5-propyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-propyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-propyl-1,2-oxazole-4-carboxamide is CCCc1oncc1C(N)=O.
What is the InChIKey of 5-propyl-1,2-oxazole-4-carboxamide?
The InChIKey is JXBFFIMLJQFWBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-2-3-6-5(7(8)10)4-9-11-6/h4H,2-3H2,1H3,(H2,8,10).
What are the key properties of 5-propyl-1,2-oxazole-4-carboxamide?
5-propyl-1,2-oxazole-4-carboxamide has a molecular weight of 154.17 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 67871556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).