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

C13H16N2O — CID 105470054

IUPAC2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine
SMILESCCc1ocnc1-c1ccccc1CCN
InChIInChI=1S/C13H16N2O/c1-2-12-13(15-9-16-12)11-6-4-3-5-10(11)7-8-14/h3-6,9H,2,7-8,14H2,1H3
InChIKeyMVQZCFSNHUFDIO-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.41
Rot. Bonds4

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

2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine (PubChem CID 105470054) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine
PubChem CID105470054
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine
SMILESCCc1ocnc1-c1ccccc1CCN
InChIInChI=1S/C13H16N2O/c1-2-12-13(15-9-16-12)11-6-4-3-5-10(11)7-8-14/h3-6,9H,2,7-8,14H2,1H3
InChIKeyMVQZCFSNHUFDIO-UHFFFAOYSA-N
XLogP2.41
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-methyl-1,3-oxazol-2-yl)phenyl]ethanamine
CID 115022622
2-[2-(2,5-dimethyl-1,3-thiazol-4-yl)phenyl]ethanamine
CID 105491880
2-(2-pyridin-2-ylphenyl)ethanamine
CID 22356817
[2-(5-methyl-1,3-oxazol-4-yl)phenyl]methanol
CID 105443456
2-[4-(5-ethyl-1,3-oxazol-4-yl)phenyl]acetic acid
CID 105489126
2-[2-(3-ethylimidazol-4-yl)phenyl]ethanamine
CID 115029288
2-[2-(3-chloropropyl)phenyl]ethanamine
CID 67894995
2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine
CID 122383957
5-[2-(2-aminoethyl)phenyl]-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791190
[2-(5-ethyl-1,3-thiazol-4-yl)phenyl]methanamine
CID 105473205
2-(2-butoxyphenyl)ethanamine;hydrochloride
CID 3045706
2-[2-[3-[2-(dimethylamino)ethyl]-1,2,4-oxadiazol-5-yl]phenyl]ethanamine
CID 115345494

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine?
The IUPAC name of 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine (CID 105470054) is 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine?
The canonical SMILES for 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine is CCc1ocnc1-c1ccccc1CCN.
What is the InChIKey of 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine?
The InChIKey is MVQZCFSNHUFDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-2-12-13(15-9-16-12)11-6-4-3-5-10(11)7-8-14/h3-6,9H,2,7-8,14H2,1H3.
What are the key properties of 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine?
2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine has a molecular weight of 216.28 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-ethyl-1,3-oxazol-4-yl)phenyl]ethanamine is sourced from PubChem (CID 105470054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).