2-(1,2-oxazol-5-ylcarbamoylamino)benzamide

C11H10N4O3 — CID 108814132

IUPAC2-(1,2-oxazol-5-ylcarbamoylamino)benzamide
SMILESNC(=O)c1ccccc1NC(=O)Nc1ccno1
InChIInChI=1S/C11H10N4O3/c12-10(16)7-3-1-2-4-8(7)14-11(17)15-9-5-6-13-18-9/h1-6H,(H2,12,16)(H2,14,15,17)
InChIKeyUJIVXWUJGRQZSX-UHFFFAOYSA-N
MW246.23 g/mol
LogP1.42
Rot. Bonds3

About 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide

2-(1,2-oxazol-5-ylcarbamoylamino)benzamide (PubChem CID 108814132) has the molecular formula C11H10N4O3 and a molecular weight of 246.23 g/mol. Its IUPAC name is 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide.

Molecular Properties

Compound Name2-(1,2-oxazol-5-ylcarbamoylamino)benzamide
PubChem CID108814132
Molecular FormulaC11H10N4O3
Molecular Weight246.23 g/mol
Exact Mass246.08
IUPAC Name2-(1,2-oxazol-5-ylcarbamoylamino)benzamide
SMILESNC(=O)c1ccccc1NC(=O)Nc1ccno1
InChIInChI=1S/C11H10N4O3/c12-10(16)7-3-1-2-4-8(7)14-11(17)15-9-5-6-13-18-9/h1-6H,(H2,12,16)(H2,14,15,17)
InChIKeyUJIVXWUJGRQZSX-UHFFFAOYSA-N
XLogP1.42
TPSA110.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide?
The IUPAC name of 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide (CID 108814132) is 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide.
What is the SMILES notation for 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide?
The canonical SMILES for 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide is NC(=O)c1ccccc1NC(=O)Nc1ccno1.
What is the InChIKey of 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide?
The InChIKey is UJIVXWUJGRQZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O3/c12-10(16)7-3-1-2-4-8(7)14-11(17)15-9-5-6-13-18-9/h1-6H,(H2,12,16)(H2,14,15,17).
What are the key properties of 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide?
2-(1,2-oxazol-5-ylcarbamoylamino)benzamide has a molecular weight of 246.23 g/mol, XLogP of 1.42, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-oxazol-5-ylcarbamoylamino)benzamide is sourced from PubChem (CID 108814132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).