2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine

C7H12N2O2 — CID 82416167

IUPAC2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine
SMILESCOCC(N)c1ncc(C)o1
InChIInChI=1S/C7H12N2O2/c1-5-3-9-7(11-5)6(8)4-10-2/h3,6H,4,8H2,1-2H3
InChIKeyNGRQTCUQNGHITG-UHFFFAOYSA-N
MW156.18 g/mol
LogP0.63
Rot. Bonds3

About 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine

2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine (PubChem CID 82416167) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine
PubChem CID82416167
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Name2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine
SMILESCOCC(N)c1ncc(C)o1
InChIInChI=1S/C7H12N2O2/c1-5-3-9-7(11-5)6(8)4-10-2/h3,6H,4,8H2,1-2H3
InChIKeyNGRQTCUQNGHITG-UHFFFAOYSA-N
XLogP0.63
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine?
The IUPAC name of 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine (CID 82416167) is 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine.
What is the SMILES notation for 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine?
The canonical SMILES for 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine is COCC(N)c1ncc(C)o1.
What is the InChIKey of 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine?
The InChIKey is NGRQTCUQNGHITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5-3-9-7(11-5)6(8)4-10-2/h3,6H,4,8H2,1-2H3.
What are the key properties of 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine?
2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine has a molecular weight of 156.18 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(5-methyl-1,3-oxazol-2-yl)ethanamine is sourced from PubChem (CID 82416167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).