2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one

C9H9N3O3 — CID 114939096

IUPAC2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one
SMILESCOc1ccc(C2OC(N)=NC2=O)cn1
InChIInChI=1S/C9H9N3O3/c1-14-6-3-2-5(4-11-6)7-8(13)12-9(10)15-7/h2-4,7H,1H3,(H2,10,12,13)
InChIKeyWICHSYOOEYMEAO-UHFFFAOYSA-N
MW207.19 g/mol
LogP0.00
Rot. Bonds2

About 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one

2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one (PubChem CID 114939096) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one.

Molecular Properties

Compound Name2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one
PubChem CID114939096
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC Name2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one
SMILESCOc1ccc(C2OC(N)=NC2=O)cn1
InChIInChI=1S/C9H9N3O3/c1-14-6-3-2-5(4-11-6)7-8(13)12-9(10)15-7/h2-4,7H,1H3,(H2,10,12,13)
InChIKeyWICHSYOOEYMEAO-UHFFFAOYSA-N
XLogP0.00
TPSA86.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one
CID 114939049
2-amino-4-(6-methoxy-3-pyridinyl)-1,4-dihydroimidazol-5-one
CID 114939075
5-amino-3-ethyl-4-(6-methoxy-3-pyridinyl)-4H-imidazol-2-one
CID 114939050
4-(6-methoxy-3-pyridinyl)azetidin-2-one
CID 114938690
4-(6-methoxy-3-pyridinyl)-1,3-oxazolidin-2-one
CID 114938799
3-(6-methoxy-3-pyridinyl)-2,2-dimethylcyclopropan-1-amine
CID 130488531
5-cyclopentyl-2-methoxypyridine
CID 102520175
2-(6-methoxy-3-pyridinyl)cyclopropane-1-carbaldehyde
CID 59988721
cis-(1R,2R)-2-(6-methoxy-3-pyridinyl)cyclopropane-1-carbaldehyde
CID 130863052
trans-(1R,2R)-2-(6-methoxy-3-pyridinyl)cyclopropane-1-carbonyl chloride
CID 129244238
5-(2-ethylcyclopropyl)-2-methoxypyridine
CID 59988749
2-(6-methoxy-3-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 126484097

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one?
The IUPAC name of 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one (CID 114939096) is 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one.
What is the SMILES notation for 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one?
The canonical SMILES for 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one is COc1ccc(C2OC(N)=NC2=O)cn1.
What is the InChIKey of 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one?
The InChIKey is WICHSYOOEYMEAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c1-14-6-3-2-5(4-11-6)7-8(13)12-9(10)15-7/h2-4,7H,1H3,(H2,10,12,13).
What are the key properties of 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one?
2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one has a molecular weight of 207.19 g/mol, XLogP of 0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one is sourced from PubChem (CID 114939096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).