5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide

C12H13N3O3 — CID 61090906

IUPAC5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCOc1ccc(N)cc1C(=O)Nc1cc(C)on1
InChIInChI=1S/C12H13N3O3/c1-7-5-11(15-18-7)14-12(16)9-6-8(13)3-4-10(9)17-2/h3-6H,13H2,1-2H3,(H,14,15,16)
InChIKeyGEYFURRZNUHDLQ-UHFFFAOYSA-N
MW247.25 g/mol
LogP1.83
Rot. Bonds3

About 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide

5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide (PubChem CID 61090906) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
PubChem CID61090906
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC Name5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCOc1ccc(N)cc1C(=O)Nc1cc(C)on1
InChIInChI=1S/C12H13N3O3/c1-7-5-11(15-18-7)14-12(16)9-6-8(13)3-4-10(9)17-2/h3-6H,13H2,1-2H3,(H,14,15,16)
InChIKeyGEYFURRZNUHDLQ-UHFFFAOYSA-N
XLogP1.83
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-(dimethylamino)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 61091290
2,4-dimethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 670331
2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 7223581
5-amino-2-methoxy-N-(1-methylpyrazol-3-yl)benzamide
CID 61104250
5-amino-N-(6-fluoro-2-pyridinyl)-2-methoxybenzamide
CID 116812517
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 2,5-dimethoxybenzoate
CID 7561076
5-amino-N-(2-chloro-4-methylphenyl)-2-methoxybenzamide
CID 61093558
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-methoxybenzamide
CID 104616428
5-amino-2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61092626
4,5-dimethoxy-N-(5-methyl-1,2-oxazol-3-yl)-2-nitrobenzamide
CID 884052
1-(4-aminophenyl)-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108812089
5-amino-2-methoxy-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 61141152

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The IUPAC name of 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide (CID 61090906) is 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide is COc1ccc(N)cc1C(=O)Nc1cc(C)on1.
What is the InChIKey of 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The InChIKey is GEYFURRZNUHDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-7-5-11(15-18-7)14-12(16)9-6-8(13)3-4-10(9)17-2/h3-6H,13H2,1-2H3,(H,14,15,16).
What are the key properties of 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide has a molecular weight of 247.25 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 61090906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).