A1IWR

(5-methyl-1,2-oxazol-3-yl)methanamine

Created:	2024-12-19
Last modified:	2025-02-05

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1 entries where A1IWR is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	16
Aromatic Bond Count	5

2D diagram of A1IWR

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Chemical Component Summary
Name	(5-methyl-1,2-oxazol-3-yl)methanamine
Systematic Name (OpenEye OEToolkits)	(5-methyl-1,2-oxazol-3-yl)methanamine
Formula	C₅ H₈ N₂ O
Molecular Weight	112.13
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1onc(CN)c1
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(no1)CN
Canonical SMILES	CACTVS	3.385	Cc1onc(CN)c1
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(no1)CN
InChI	InChI	1.06	InChI=1S/C5H8N2O/c1-4-2-5(3-6)7-8-4/h2H,3,6H2,1H3
InChIKey	InChI	1.06	AZVWIMLQRLKLHH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	2776306

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