4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide

C6H9N3O2 — CID 67264142

IUPAC4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCNC(=O)c1noc(C)c1N
InChIInChI=1S/C6H9N3O2/c1-3-4(7)5(9-11-3)6(10)8-2/h7H2,1-2H3,(H,8,10)
InChIKeyMTRLGNGDPVOGLH-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.08
Rot. Bonds1

About 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide

4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide (PubChem CID 67264142) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide
PubChem CID67264142
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCNC(=O)c1noc(C)c1N
InChIInChI=1S/C6H9N3O2/c1-3-4(7)5(9-11-3)6(10)8-2/h7H2,1-2H3,(H,8,10)
InChIKeyMTRLGNGDPVOGLH-UHFFFAOYSA-N
XLogP-0.08
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2,6-Dimethylpiperidino)(5-methyl-4-nitro-3-isoxazolyl)methanone
CID 12004924
N-cyclohexyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
CID 20864741
5-Methyl-4-nitro-N-(prop-2-yn-1-yl)isoxazole-3-carboxamide
CID 162666797
1-[4-(5-Methyl-4-nitro-1,2-oxazole-3-carbonyl)piperazin-1-yl]propan-1-one
CID 57401199
N,N,5-trimethyl-4-nitro-1,2-oxazole-3-carboxamide
CID 162645327
4-amino-N,N-dimethyl-5-(trifluoromethyl)-1,2-oxazole-3-carboxamide
CID 70431346
5-Methyl-4-nitro-N-[(oxolan-2-YL)methyl]-1,2-oxazole-3-carboxamide
CID 20864738
4-Methyl-1-(5-methyl-4-nitro-1,2-oxazole-3-carbonyl)piperidine
CID 20864739
N-cyclopentyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
CID 20864740
1-(5-Methyl-4-nitro-1,2-oxazole-3-carbonyl)azepane
CID 20864745
N-cyclohexyl-N,5-dimethyl-4-nitro-1,2-oxazole-3-carboxamide
CID 20864746
(5-Methyl-4-nitro-1,2-oxazol-3-yl)-piperidin-1-ylmethanone
CID 20864747

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide (CID 67264142) is 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide is CNC(=O)c1noc(C)c1N.
What is the InChIKey of 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The InChIKey is MTRLGNGDPVOGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-3-4(7)5(9-11-3)6(10)8-2/h7H2,1-2H3,(H,8,10).
What are the key properties of 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide?
4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide has a molecular weight of 155.16 g/mol, XLogP of -0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,5-dimethyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 67264142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).