5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide

C17H16N4O4 — CID 91086247

IUPAC5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide
SMILESCOc1cc(NC(=O)c2c(-c3ccccn3)noc2N)cc(OC)c1
InChIInChI=1S/C17H16N4O4/c1-23-11-7-10(8-12(9-11)24-2)20-17(22)14-15(21-25-16(14)18)13-5-3-4-6-19-13/h3-9H,18H2,1-2H3,(H,20,22)
InChIKeyWGQSMUSQTVONGL-UHFFFAOYSA-N
MW340.34 g/mol
LogP2.59
Rot. Bonds5

About 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide

5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide (PubChem CID 91086247) has the molecular formula C17H16N4O4 and a molecular weight of 340.34 g/mol. Its IUPAC name is 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide
PubChem CID91086247
Molecular FormulaC17H16N4O4
Molecular Weight340.34 g/mol
Exact Mass340.12
IUPAC Name5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide
SMILESCOc1cc(NC(=O)c2c(-c3ccccn3)noc2N)cc(OC)c1
InChIInChI=1S/C17H16N4O4/c1-23-11-7-10(8-12(9-11)24-2)20-17(22)14-15(21-25-16(14)18)13-5-3-4-6-19-13/h3-9H,18H2,1-2H3,(H,20,22)
InChIKeyWGQSMUSQTVONGL-UHFFFAOYSA-N
XLogP2.59
TPSA112.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-amino-N-(3-phenylmethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide
CID 91549211
5-(furan-2-carbonylamino)-N-(4-methoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide
CID 91517925
5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide
CID 91305047
N-(4-methoxyphenyl)-3-pyridin-2-yl-5-(pyridin-3-ylcarbamoylamino)-1,2-oxazole-4-carboxamide
CID 91290030
N-(3-methoxyphenyl)-2-pyridin-2-ylpyridine-3-carboxamide
CID 10125587
3,5-dimethoxy-N-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)phenyl]benzamide
CID 30330865
N-(3,5-dimethoxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 27285765
N-(3-methoxyphenyl)-2-pyridin-2-ylbenzamide
CID 140997803
N-(3,5-dimethoxyphenyl)-4-hydroxy-2-oxo-1H-1,8-naphthyridine-3-carboxamide
CID 54726859
2,6-dichloro-N-(3,5-dimethoxyphenyl)benzamide
CID 891393
N-(3,5-dimethoxyphenyl)-2-methyl-2-(4-pyridin-2-ylpyrazol-1-yl)propanamide
CID 71447691
4-(3-acetamido-2-pyridinyl)-N-(3,5-dimethoxyphenyl)benzamide
CID 46386365

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide (CID 91086247) is 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide is COc1cc(NC(=O)c2c(-c3ccccn3)noc2N)cc(OC)c1.
What is the InChIKey of 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide?
The InChIKey is WGQSMUSQTVONGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O4/c1-23-11-7-10(8-12(9-11)24-2)20-17(22)14-15(21-25-16(14)18)13-5-3-4-6-19-13/h3-9H,18H2,1-2H3,(H,20,22).
What are the key properties of 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide?
5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide has a molecular weight of 340.34 g/mol, XLogP of 2.59, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3,5-dimethoxyphenyl)-3-pyridin-2-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 91086247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).