1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine

C14H18N2O2 — CID 103913113

IUPAC1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine
SMILESCCOc1ccccc1C(C)NCc1ccno1
InChIInChI=1S/C14H18N2O2/c1-3-17-14-7-5-4-6-13(14)11(2)15-10-12-8-9-16-18-12/h4-9,11,15H,3,10H2,1-2H3
InChIKeyDSXFBBHGVFFXSO-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.92
Rot. Bonds6

About 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine

1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine (PubChem CID 103913113) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine
PubChem CID103913113
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine
SMILESCCOc1ccccc1C(C)NCc1ccno1
InChIInChI=1S/C14H18N2O2/c1-3-17-14-7-5-4-6-13(14)11(2)15-10-12-8-9-16-18-12/h4-9,11,15H,3,10H2,1-2H3
InChIKeyDSXFBBHGVFFXSO-UHFFFAOYSA-N
XLogP2.92
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-5-ylmethyl)-1-pyridin-2-ylethanamine
CID 103605434
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-(2-ethoxyphenyl)ethanamine
CID 79237158
1-(2-ethoxyphenyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]ethanamine
CID 103913111
1-(2-ethoxyphenyl)-N-(1,2,4-oxadiazol-3-ylmethyl)ethanamine
CID 106392807
1-(2-ethoxyphenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 103913115
(1R)-1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]propan-1-amine
CID 55190081
1-(2-ethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 60859643
4-[[1-(2-ethoxyphenyl)ethylamino]methyl]phenol
CID 115715689
1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]-N-propylpropan-1-amine
CID 60882098
N-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-1-(2-ethoxyphenyl)ethanamine;dihydrochloride
CID 155819724
2-[1-(1,2-oxazol-5-ylmethylamino)ethyl]benzene-1,3-diol
CID 106415565
N-[2-[1-(2-ethoxyphenyl)ethylamino]ethyl]-2-methylpropanamide
CID 43203001

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine (CID 103913113) is 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine is CCOc1ccccc1C(C)NCc1ccno1.
What is the InChIKey of 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The InChIKey is DSXFBBHGVFFXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-3-17-14-7-5-4-6-13(14)11(2)15-10-12-8-9-16-18-12/h4-9,11,15H,3,10H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine?
1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine has a molecular weight of 246.31 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)ethanamine is sourced from PubChem (CID 103913113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).