5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine

C6H5N3O2 — CID 96636086

IUPAC5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine
SMILESNc1cnoc1-c1cocn1
InChIInChI=1S/C6H5N3O2/c7-4-1-9-11-6(4)5-2-10-3-8-5/h1-3H,7H2
InChIKeyVPOOJNVUVGTBLO-UHFFFAOYSA-N
MW151.12 g/mol
LogP0.91
Rot. Bonds1

About 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine

5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine (PubChem CID 96636086) has the molecular formula C6H5N3O2 and a molecular weight of 151.12 g/mol. Its IUPAC name is 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound Name5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine
PubChem CID96636086
Molecular FormulaC6H5N3O2
Molecular Weight151.12 g/mol
Exact Mass151.04
IUPAC Name5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine
SMILESNc1cnoc1-c1cocn1
InChIInChI=1S/C6H5N3O2/c7-4-1-9-11-6(4)5-2-10-3-8-5/h1-3H,7H2
InChIKeyVPOOJNVUVGTBLO-UHFFFAOYSA-N
XLogP0.91
TPSA78.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.12
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-phenyl-1,2-oxazol-4-amine
CID 45117984
pyrrolo[3,4-d][1,3]oxazin-5-amine
CID 162789178
5-(4-fluorophenyl)-1,2-oxazol-4-amine
CID 82410181
4-(thiatriazol-5-yl)-1,3-oxazole
CID 54566276
5-propan-2-yl-1,2-oxazol-4-amine
CID 14341208
5-[3-(trifluoromethyl)phenyl]-1,2-oxazol-4-amine
CID 105485175
5-(3-chlorophenyl)-1,2-oxazol-4-amine
CID 82400734
4-(1,3-oxazol-4-yl)-2-propyl-1,3-oxazole
CID 89186950
2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-6-ol
CID 136986506
4-(1,3-oxazol-4-yl)benzoic acid
CID 69180144
5-(aminomethyl)-1,2-oxazol-4-amine
CID 117217402
5-(6-bromo-1-methylindol-2-yl)-1,2-oxazol-4-amine
CID 115109324

Frequently Asked Questions

What is the IUPAC name of 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine?
The IUPAC name of 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine (CID 96636086) is 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine?
The canonical SMILES for 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine is Nc1cnoc1-c1cocn1.
What is the InChIKey of 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine?
The InChIKey is VPOOJNVUVGTBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O2/c7-4-1-9-11-6(4)5-2-10-3-8-5/h1-3H,7H2.
What are the key properties of 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine?
5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine has a molecular weight of 151.12 g/mol, XLogP of 0.91, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3-oxazol-4-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 96636086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).