2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine

C13H19N3O3 — CID 141063314

IUPAC2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine
SMILESCOCC(C)N1OC(N)=CC1c1ccc(OC)nc1
InChIInChI=1S/C13H19N3O3/c1-9(8-17-2)16-11(6-12(14)19-16)10-4-5-13(18-3)15-7-10/h4-7,9,11H,8,14H2,1-3H3
InChIKeyDJBBOQTWZIUYJB-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.21
Rot. Bonds5

About 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine

2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine (PubChem CID 141063314) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine.

Molecular Properties

Compound Name2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine
PubChem CID141063314
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine
SMILESCOCC(C)N1OC(N)=CC1c1ccc(OC)nc1
InChIInChI=1S/C13H19N3O3/c1-9(8-17-2)16-11(6-12(14)19-16)10-4-5-13(18-3)15-7-10/h4-7,9,11H,8,14H2,1-3H3
InChIKeyDJBBOQTWZIUYJB-UHFFFAOYSA-N
XLogP1.21
TPSA69.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(5-chlorofuran-2-yl)-2-(1-methoxypropan-2-yl)-3H-1,2-oxazol-5-amine
CID 141063510
2-[2-(cyclohexen-1-yl)ethyl]-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine
CID 141063419
3-(6-methoxy-3-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-3H-1,2-oxazol-5-amine
CID 141063449
5-amino-3-ethyl-4-(6-methoxy-3-pyridinyl)-4H-imidazol-2-one
CID 114939050
5-cyclopentyl-2-methoxypyridine
CID 102520175
4-(6-methoxy-3-pyridinyl)azetidin-2-one
CID 114938690
5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one
CID 114939049
[3-(6-methoxy-3-pyridinyl)-4-propan-2-ylmorpholin-2-yl]methanamine
CID 114938575
6-(2-methylpropoxy)pyridin-3-amine
CID 3031383
2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one
CID 114939096
2-methoxy-1-(6-methoxy-3-pyridinyl)ethanol
CID 114937935
3-(6-methoxy-3-pyridinyl)-2,2-dimethylcyclopropan-1-amine
CID 130488531

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine?
The IUPAC name of 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine (CID 141063314) is 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine.
What is the SMILES notation for 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine?
The canonical SMILES for 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine is COCC(C)N1OC(N)=CC1c1ccc(OC)nc1.
What is the InChIKey of 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine?
The InChIKey is DJBBOQTWZIUYJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-9(8-17-2)16-11(6-12(14)19-16)10-4-5-13(18-3)15-7-10/h4-7,9,11H,8,14H2,1-3H3.
What are the key properties of 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine?
2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine has a molecular weight of 265.31 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-yl)-3-(6-methoxy-3-pyridinyl)-3H-1,2-oxazol-5-amine is sourced from PubChem (CID 141063314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).