1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine

C16H15N3O — CID 71295236

IUPAC1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine
SMILESCC(N)c1nc(-c2ccccc2)oc1-c1cccnc1
InChIInChI=1S/C16H15N3O/c1-11(17)14-15(13-8-5-9-18-10-13)20-16(19-14)12-6-3-2-4-7-12/h2-11H,17H2,1H3
InChIKeyLQLNRKLVKFNTCA-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.42
Rot. Bonds3

About 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine

1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine (PubChem CID 71295236) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine.

Molecular Properties

Compound Name1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine
PubChem CID71295236
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine
SMILESCC(N)c1nc(-c2ccccc2)oc1-c1cccnc1
InChIInChI=1S/C16H15N3O/c1-11(17)14-15(13-8-5-9-18-10-13)20-16(19-14)12-6-3-2-4-7-12/h2-11H,17H2,1H3
InChIKeyLQLNRKLVKFNTCA-UHFFFAOYSA-N
XLogP3.42
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine?
The IUPAC name of 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine (CID 71295236) is 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine.
What is the SMILES notation for 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine?
The canonical SMILES for 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine is CC(N)c1nc(-c2ccccc2)oc1-c1cccnc1.
What is the InChIKey of 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine?
The InChIKey is LQLNRKLVKFNTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11(17)14-15(13-8-5-9-18-10-13)20-16(19-14)12-6-3-2-4-7-12/h2-11H,17H2,1H3.
What are the key properties of 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine?
1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine has a molecular weight of 265.32 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-5-pyridin-3-yl-1,3-oxazol-4-yl)ethanamine is sourced from PubChem (CID 71295236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).