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

C16H16N2O3 — CID 66199843

IUPAC4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
SMILESCCOc1ccc(-c2c(N)noc2-c2ccoc2C)cc1
InChIInChI=1S/C16H16N2O3/c1-3-19-12-6-4-11(5-7-12)14-15(21-18-16(14)17)13-8-9-20-10(13)2/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyKHSXPYCDWLEWRL-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.89
Rot. Bonds4

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

4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine (PubChem CID 66199843) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
PubChem CID66199843
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
SMILESCCOc1ccc(-c2c(N)noc2-c2ccoc2C)cc1
InChIInChI=1S/C16H16N2O3/c1-3-19-12-6-4-11(5-7-12)14-15(21-18-16(14)17)13-8-9-20-10(13)2/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyKHSXPYCDWLEWRL-UHFFFAOYSA-N
XLogP3.89
TPSA74.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-ethoxyphenyl)-5-methyl-1,2-oxazol-3-amine
CID 66199638
4-(3-methoxy-4-methylphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 66198425
5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66198480
4-(3-fluorophenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 66198177
5-tert-butyl-4-(4-ethoxyphenyl)-1,2-oxazol-3-amine
CID 66200446
5-(2-methylfuran-3-yl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66204587
5-(4-ethoxyphenyl)-4-pyridin-3-yl-1,2-oxazol-3-amine
CID 80522490
4-(4-ethoxyphenyl)-5-(methylsulfonylmethyl)-1,2-oxazol-3-amine
CID 66200647
5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66198467
4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine
CID 106754464
4-(4-ethoxyphenyl)-5-(oxan-3-yl)-1,2-oxazol-3-amine
CID 66199845
4-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2-oxazol-5-amine
CID 43336169

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine (CID 66199843) is 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine is CCOc1ccc(-c2c(N)noc2-c2ccoc2C)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine?
The InChIKey is KHSXPYCDWLEWRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-3-19-12-6-4-11(5-7-12)14-15(21-18-16(14)17)13-8-9-20-10(13)2/h4-9H,3H2,1-2H3,(H2,17,18).
What are the key properties of 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine?
4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine has a molecular weight of 284.32 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66199843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).