5-(4-ethoxyphenyl)-1,2-oxazol-3-amine

C11H12N2O2 — CID 27242742

IUPAC5-(4-ethoxyphenyl)-1,2-oxazol-3-amine
SMILESCCOc1ccc(-c2cc(N)no2)cc1
InChIInChI=1S/C11H12N2O2/c1-2-14-9-5-3-8(4-6-9)10-7-11(12)13-15-10/h3-7H,2H2,1H3,(H2,12,13)
InChIKeyMIJDABQRKNNWJP-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.32
Rot. Bonds3

About 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine

5-(4-ethoxyphenyl)-1,2-oxazol-3-amine (PubChem CID 27242742) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-1,2-oxazol-3-amine
PubChem CID27242742
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name5-(4-ethoxyphenyl)-1,2-oxazol-3-amine
SMILESCCOc1ccc(-c2cc(N)no2)cc1
InChIInChI=1S/C11H12N2O2/c1-2-14-9-5-3-8(4-6-9)10-7-11(12)13-15-10/h3-7H,2H2,1H3,(H2,12,13)
InChIKeyMIJDABQRKNNWJP-UHFFFAOYSA-N
XLogP2.32
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-propan-2-yloxyphenyl)-1,2-oxazol-3-amine
CID 82472063
5-[4-(diethylamino)phenyl]-1,2-oxazol-3-amine
CID 117334620
5-(4-ethylsulfanylphenyl)-1,2-oxazol-3-amine
CID 82472660
[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate
CID 175331108
ethane;5-phenyl-1,2-oxazol-3-amine
CID 145311661
5-[4-(1,3-oxazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326354
4-(4-ethoxyphenyl)-5-methyl-1,2-oxazol-3-amine
CID 66199638
5-[4-(oxan-4-yloxy)phenyl]-1,2-oxazol-3-amine
CID 117404768
5-(3-bromo-4-pentan-3-ylphenyl)-1,2-oxazol-3-amine
CID 117493981
5-[4-(1,1-dioxothietan-3-yl)oxyphenyl]-1,2-oxazol-3-amine
CID 117449852
2-[5-(4-propoxyphenyl)-1,2-oxazol-3-yl]ethanamine
CID 95732607
5-(1-methylpyrrol-3-yl)-1,2-oxazol-3-amine
CID 82467912

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine (CID 27242742) is 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine is CCOc1ccc(-c2cc(N)no2)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine?
The InChIKey is MIJDABQRKNNWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-2-14-9-5-3-8(4-6-9)10-7-11(12)13-15-10/h3-7H,2H2,1H3,(H2,12,13).
What are the key properties of 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine?
5-(4-ethoxyphenyl)-1,2-oxazol-3-amine has a molecular weight of 204.23 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 27242742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).