1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine

C15H20N2O3 — CID 65181194

IUPAC1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
SMILESCCNC(C)c1ncc(-c2ccc(OC)cc2OC)o1
InChIInChI=1S/C15H20N2O3/c1-5-16-10(2)15-17-9-14(20-15)12-7-6-11(18-3)8-13(12)19-4/h6-10,16H,5H2,1-4H3
InChIKeyWNLSNCKEZFTVFF-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.03
Rot. Bonds6

About 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine

1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine (PubChem CID 65181194) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine.

Molecular Properties

Compound Name1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
PubChem CID65181194
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
SMILESCCNC(C)c1ncc(-c2ccc(OC)cc2OC)o1
InChIInChI=1S/C15H20N2O3/c1-5-16-10(2)15-17-9-14(20-15)12-7-6-11(18-3)8-13(12)19-4/h6-10,16H,5H2,1-4H3
InChIKeyWNLSNCKEZFTVFF-UHFFFAOYSA-N
XLogP3.03
TPSA56.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181244
N-ethyl-1-[5-(2,3,4-trifluorophenyl)-1,3-oxazol-2-yl]ethanamine
CID 79756753
1-[5-(2,5-dibromophenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 114375998
N-ethyl-1-[5-(4-methoxy-3-nitrophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181398
N-ethyl-1-[5-(2-iodophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181348
1-[2-(2,4-dimethoxyphenyl)phenyl]-N-ethylethanamine
CID 61033910
1-[5-(5-chlorofuran-2-yl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 106690342
1-[5-(5-bromofuran-2-yl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 65181498
N-ethyl-1-[5-(3-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181800
5-(2,4-dimethoxyphenyl)-1,3-oxazole-2-carboxylic acid
CID 82049476
1-[5-(4-bromo-2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 113296242
2-(1-chloroethyl)-5-(2-fluoro-4-methoxyphenyl)-1,3-oxazole
CID 102885537

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine?
The IUPAC name of 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine (CID 65181194) is 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine.
What is the SMILES notation for 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine?
The canonical SMILES for 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine is CCNC(C)c1ncc(-c2ccc(OC)cc2OC)o1.
What is the InChIKey of 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine?
The InChIKey is WNLSNCKEZFTVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-5-16-10(2)15-17-9-14(20-15)12-7-6-11(18-3)8-13(12)19-4/h6-10,16H,5H2,1-4H3.
What are the key properties of 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine?
1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine has a molecular weight of 276.34 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine is sourced from PubChem (CID 65181194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).