5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine

C8H14N2O2 — CID 13339614

IUPAC5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine
SMILESCOCC(C)(C)c1cc(N)no1
InChIInChI=1S/C8H14N2O2/c1-8(2,5-11-3)6-4-7(9)10-12-6/h4H,5H2,1-3H3,(H2,9,10)
InChIKeyISFBSBAZSPGMSW-UHFFFAOYSA-N
MW170.21 g/mol
LogP1.18
Rot. Bonds3

About 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine

5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine (PubChem CID 13339614) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine
PubChem CID13339614
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine
SMILESCOCC(C)(C)c1cc(N)no1
InChIInChI=1S/C8H14N2O2/c1-8(2,5-11-3)6-4-7(9)10-12-6/h4H,5H2,1-3H3,(H2,9,10)
InChIKeyISFBSBAZSPGMSW-UHFFFAOYSA-N
XLogP1.18
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine (CID 13339614) is 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine is COCC(C)(C)c1cc(N)no1.
What is the InChIKey of 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine?
The InChIKey is ISFBSBAZSPGMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-8(2,5-11-3)6-4-7(9)10-12-6/h4H,5H2,1-3H3,(H2,9,10).
What are the key properties of 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine?
5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine has a molecular weight of 170.21 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-amine is sourced from PubChem (CID 13339614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).