3-amino-5-methyl-1,2-oxazole-4-carboxamide

C5H7N3O2 — CID 118920356

IUPAC3-amino-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(N)c1C(N)=O
InChIInChI=1S/C5H7N3O2/c1-2-3(5(7)9)4(6)8-10-2/h1H3,(H2,6,8)(H2,7,9)
InChIKeyJHVCBJSZFKQHKB-UHFFFAOYSA-N
MW141.13 g/mol
LogP-0.34
Rot. Bonds1

About 3-amino-5-methyl-1,2-oxazole-4-carboxamide

3-amino-5-methyl-1,2-oxazole-4-carboxamide (PubChem CID 118920356) has the molecular formula C5H7N3O2 and a molecular weight of 141.13 g/mol. Its IUPAC name is 3-amino-5-methyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-5-methyl-1,2-oxazole-4-carboxamide
PubChem CID118920356
Molecular FormulaC5H7N3O2
Molecular Weight141.13 g/mol
Exact Mass141.05
IUPAC Name3-amino-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(N)c1C(N)=O
InChIInChI=1S/C5H7N3O2/c1-2-3(5(7)9)4(6)8-10-2/h1H3,(H2,6,8)(H2,7,9)
InChIKeyJHVCBJSZFKQHKB-UHFFFAOYSA-N
XLogP-0.34
TPSA95.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,5-Dimethylisoxazol-3-amine
CID 84148
5-Methylisoxazole-4-carboxamide
CID 18366019
Dimethyl-1,2-oxazol-3-amine hydrochloride
CID 18800890
3-Amino-5-methyl-1,2-oxazole-4-carboxylic acid
CID 55284337
4,5-Dimethyl-3-(sulfinatoamino)-1,2-oxazole
CID 69135005
3-Amino-5-tert-butyl-1,2-oxazole-4-carboxamide
CID 117703609
4,5-Dimethyl-1,2-oxazol-3-amine;molecular hydrogen;hydrate
CID 143915850
4,5-Dimethyl-1,2-oxazol-3-amine;ethane
CID 144672034
4-(Deuteriomethyl)-5-methyl-1,2-oxazol-3-amine
CID 167483538
3-Isocyanato-4,5-dimethyl-1,2-oxazole
CID 83913953
1-(3-Amino-5-methyl-1,2-oxazol-4-yl)ethanone
CID 105428109
3-Amino-5-propyl-1,2-oxazole-4-carboxamide
CID 129935862

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-methyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-amino-5-methyl-1,2-oxazole-4-carboxamide (CID 118920356) is 3-amino-5-methyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-amino-5-methyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-amino-5-methyl-1,2-oxazole-4-carboxamide is Cc1onc(N)c1C(N)=O.
What is the InChIKey of 3-amino-5-methyl-1,2-oxazole-4-carboxamide?
The InChIKey is JHVCBJSZFKQHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2/c1-2-3(5(7)9)4(6)8-10-2/h1H3,(H2,6,8)(H2,7,9).
What are the key properties of 3-amino-5-methyl-1,2-oxazole-4-carboxamide?
3-amino-5-methyl-1,2-oxazole-4-carboxamide has a molecular weight of 141.13 g/mol, XLogP of -0.34, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-methyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 118920356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).