2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine

C13H16N2O2 — CID 94685630

IUPAC2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine
SMILESCCOc1ccc(-c2ncoc2CCN)cc1
InChIInChI=1S/C13H16N2O2/c1-2-16-11-5-3-10(4-6-11)13-12(7-8-14)17-9-15-13/h3-6,9H,2,7-8,14H2,1H3
InChIKeyBLTIFMHUTKVMRS-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.24
Rot. Bonds5

About 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine

2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine (PubChem CID 94685630) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine
PubChem CID94685630
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine
SMILESCCOc1ccc(-c2ncoc2CCN)cc1
InChIInChI=1S/C13H16N2O2/c1-2-16-11-5-3-10(4-6-11)13-12(7-8-14)17-9-15-13/h3-6,9H,2,7-8,14H2,1H3
InChIKeyBLTIFMHUTKVMRS-UHFFFAOYSA-N
XLogP2.24
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(4-fluoro-3-methylphenyl)-1,3-oxazol-5-yl]ethanamine
CID 82127608
2-[4-(5-methyl-1,3-oxazol-4-yl)phenyl]ethanamine
CID 105454401
6-(4-ethoxyphenyl)-1,2,4-triazin-5-amine
CID 116822998
2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethanamine
CID 1497789
[5-(4-ethoxyphenyl)-1,3-oxazol-4-yl]methanol
CID 79145618
2-[5-(4-ethoxyphenyl)-1-methylpyrazol-3-yl]ethanamine
CID 82072251
2-[5-(4-ethoxyphenyl)-1-methyl-1,2,4-triazol-3-yl]ethanamine
CID 96662776
[5-(4-butoxyphenyl)-1,3-oxazol-4-yl]methanamine
CID 79139143
4-(4-ethoxyphenyl)-1,3-oxazol-2-amine
CID 62065908
5-(4-ethoxyphenyl)-3-methylimidazol-4-amine
CID 62018469
[3-(4-ethoxyphenyl)pyrazin-2-yl]hydrazine
CID 112559554
4-(4-ethoxyphenyl)-5-methyl-2H-triazole
CID 170147551

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine?
The IUPAC name of 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine (CID 94685630) is 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine.
What is the SMILES notation for 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine?
The canonical SMILES for 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine is CCOc1ccc(-c2ncoc2CCN)cc1.
What is the InChIKey of 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine?
The InChIKey is BLTIFMHUTKVMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-16-11-5-3-10(4-6-11)13-12(7-8-14)17-9-15-13/h3-6,9H,2,7-8,14H2,1H3.
What are the key properties of 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine?
2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine has a molecular weight of 232.28 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-ethoxyphenyl)-1,3-oxazol-5-yl]ethanamine is sourced from PubChem (CID 94685630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).